Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.68 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.49 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.49 |
| ▸ | PLK1 | P53350 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3161907 | 0.89 | ALDH1A1 (0.71) | ALDH1A1HTTALOX15NPC1POLB | |
| Hydrochloric Acid SCHEMBL27728003 | 0.87 | ALDH1A1 (0.69) | ALDH1A1HTTALOX15NPC1POLB | |
| SCHEMBL933273 | 0.87 | CYP3A4 (0.56) | ALDH1A1HTTALOX15NPC1POLB | |
| SCHEMBL3171559 | 0.85 | ALDH1A1 (0.67) | ALDH1A1HTTALOX15NPC1POLB | |
| SCHEMBL6985088 | 0.85 | ALDH1A1 (0.67) | ALDH1A1HTTALOX15NPC1POLB | |
| SCHEMBL2468542 | 0.84 | KMT2A (0.67) | ALDH1A1HTTALOX15NPC1POLB | |
| SCHEMBL19924516 | 0.84 | ALDH1A1 (0.69) | ALDH1A1HTTALOX15NPC1POLB | |
| SCHEMBL19924517 | 0.83 | ALDH1A1 (0.64) | ALDH1A1HTTALOX15NPC1POLB | |
| SCHEMBL2494747 | 0.83 | ALDH1A1 (0.72) | ALDH1A1HTTALOX15NPC1POLB | |
| SCHEMBL29541514 | 0.83 | ALDH1A1 (0.63) | ALDH1A1HTTALOX15NPC1POLB |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108697709-A | Methods for treating huntington's disease | PTC医疗公司 | 2018-10-23 | — | — | CN | claimed |
| EP-1320523-B1 | BRANCHED CHAIN AMINO ACID-DEPENDENT AMINOTRANSFERASE INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES | WARNER LAMBERT CO (US) | 2005-06-22 | — | — | EP | claimed |
| EP-0730597-B1 | HETEROCYCLIC ESTERS OF RAPAMYCIN AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | AMERICAN HOME PROD (US) | 2001-03-07 | — | — | EP | claimed |
| EP-0639570-A1 | Process for the preparation of aromatic carboxylic acids | BASF Aktiengesellschaft (DE) | 1995-02-22 | — | — | EP | claimed |
| EP-1448530-B1 | HETEROARYL CARBOXYLIC ACID AMIDES | BAYER HEALTHCARE AG (DE) | 2007-10-03 | — | — | EP | disclosed |
| EP-1448530-A1 | HETEROARYL CARBOXYLIC ACID AMIDES | Bayer HealthCare AG (DE) | 2004-08-25 | — | — | EP | disclosed |
| EP-0944582-B1 | KETOBENZAMIDES AS CALPAIN INHIBITORS | ABBOTT GMBH & CO KG (DE) | 2003-07-02 | — | — | EP | disclosed |
| WO-2003043991-A1 | HETEROARYL CARBOXYLIC ACID AMIDES | BAYER HEALTHCARE AG (DE) | 2003-05-30 | — | — | WO | disclosed |
| EP-0944582-A1 | KETOBENZAMIDES AS CALPAIN INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 1999-09-29 | — | — | EP | disclosed |
| EP-0707656-B1 | BIOTECHNOLOGICAL PROCESS FOR PRODUCING ALCOHOLS, ALDEHYDES AND CARBOXYLIC ACIDS | BASF AG (DE) | 1998-09-02 | — | — | EP | disclosed |
| WO-1998025883-A1 | KETOBENZAMIDES AS CALPAIN INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 1998-06-18 | — | — | WO | disclosed |
| EP-0675111-A2 | Process for the preparation of 6-hydroxymethyl-quinolines | BASF AKTIENGESELLSCHAFT (DE) | 1995-10-04 | — | — | EP | disclosed |
| EP-0639570-A1 | Process for the preparation of aromatic carboxylic acids | BASF Aktiengesellschaft (DE) | 1995-02-22 | — | — | EP | disclosed |