Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.63 |
| ▸ | POLB | P06746 | 2/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 12/20 | 0.57 |
| ▸ | MAPT | P10636 | 4/20 | 0.57 |
| ▸ | RAB9A | P51151 | 2/20 | 0.57 |
| ▸ | NPC1 | O15118 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | UNG | P13051 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | MAOA | P21397 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 1/20 | 0.51 |
| ▸ | SRC | P12931 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.47 |
| ▸ | NSD2 | O96028 | 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 | |
|---|---|---|---|---|
| SCHEMBL17758430 | 0.90 | UNG (0.61) | ALDH1A1POLBKMT2AMAPTRAB9A | |
| SCHEMBL6155296 | 0.90 | ALDH1A1 (0.53) | ALDH1A1POLBKMT2AMAPTRAB9A | |
| Thiosemicarbazide SCHEMBL28426851 | 0.88 | KMT2A (0.53) | ALDH1A1POLBKMT2AMAPTRAB9A | |
| SCHEMBL18176621 | 0.86 | KMT2A (0.54) | ALDH1A1POLBKMT2AMAPTRAB9A | |
| SCHEMBL4294411 | 0.86 | KMT2A (0.68) | ALDH1A1POLBKMT2AMAPTRAB9A | |
| SCHEMBL28991764 | 0.86 | ALDH1A1 (0.63) | ALDH1A1POLBKMT2AMAPTRAB9A | |
| SCHEMBL5444107 | 0.85 | KMT2A (0.54) | ALDH1A1POLBKMT2AMAPTRAB9A | |
| SCHEMBL1785471 | 0.84 | KMT2A (0.69) | ALDH1A1POLBKMT2AMAPTMEN1 | |
| SCHEMBL18271800 | 0.83 | ESR1 (0.64) | ALDH1A1POLBKMT2AMAPTRAB9A | |
| SCHEMBL20958113 | 0.82 | SRC (0.56) | ALDH1A1POLBKMT2AMAPTRAB9A |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007140109-A1 | CYCLOPROPYL FUSED INDOLOBENZAZEPINE HCV NS5B INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-12-06 | — | — | WO | disclosed |
| WO-2005030709-A1 | NOVEL SULFONE AMIDE DERIVATIVES CAPABLE OF INHIBITING BACE | LG LIFE SCIENCES LTD. (KR) | 2005-04-07 | — | — | WO | disclosed |
| CN-1100759-C | Xanthene and arcridine derivative and its use | HOFFMANN LA ROCHE (CH) | 2003-02-05 | — | — | CN | disclosed |
| EP-0949226-B1 | Process for the preparation of acetylene derivatives | MITSUI CHEMICALS INC (JP) | 2002-07-17 | — | — | EP | disclosed |
| US-6162918-A | Xanthene and acridine derivatives | HOFFMANN-LA ROCHE INC. (US) | 2000-12-19 | — | — | US | disclosed |
| US-6127583-A | Process for preparing acetylene derivative from a ketone compound | MITSUI CHEMICALS, INC. (JP) | 2000-10-03 | — | — | US | disclosed |
| CN-1234380-A | Process for preparing acetylene derivative | NII CHEMICAL CO LTD (JP) | 1999-11-10 | — | — | CN | disclosed |
| US-5969139-A | INHIBITORS OF HERPES SIMPLEX VIRUS THYMIDINE KINASE | HOFFMANN-LA ROCHE INC. (US) | 1999-10-19 | — | — | US | disclosed |
| EP-0949226-A1 | Process for the preparation of acetylene derivatives | Mitsui Chemicals, Inc. (JP) | 1999-10-13 | — | — | EP | disclosed |
| CN-1178789-A | Xanthene and arcridine derivative and its use | HOFFMANN LA ROCHE (CH) | 1998-04-15 | — | — | CN | disclosed |
| EP-0823426-A1 | Xanthene and acridine derivatives and their use | F. HOFFMANN-LA ROCHE AG (CH) | 1998-02-11 | — | — | EP | disclosed |