Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3158948 | 0.98 | TDP1 (0.51) | TDP1CYP2D6CYP2C19ALDH1A1KDM4E | |
| SCHEMBL4558224 | 0.85 | KMT2A (0.48) | TDP1CYP2D6CYP2C19ALDH1A1LMNA | |
| SCHEMBL27395096 | 0.81 | CYP2A13 (0.46) | TDP1CYP2D6CYP2C19ALDH1A1USP2 | |
| SCHEMBL29995599 | 0.80 | CA12 (0.52) | ALDH1A1POLBMAPK1MEN1KMT2A | |
| SCHEMBL11548078 | 0.80 | CA12 (0.52) | ALDH1A1POLBMAPK1MEN1KMT2A | |
| SCHEMBL16825239 | 0.78 | KDM4E (0.43) | ALDH1A1KDM4ELMNAPOLBALOX15 | |
| SCHEMBL3825653 | 0.76 | ALDH1A1 (0.46) | TDP1CYP2D6CYP2C19ALDH1A1KDM4E | |
| SCHEMBL10701429 | 0.76 | KEAP1 (0.47) | TDP1CYP2C19ALDH1A1KDM4ELMNA | |
| SCHEMBL6242418 | 0.76 | TSHR (0.53) | TDP1CYP2D6CYP2C19ALDH1A1KDM4E | |
| SCHEMBL4504681 | 0.76 | ALDH1A1 (0.44) | TDP1ALDH1A1KDM4ELMNAPOLB |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115210225-A | Substituted aminoquinolones as immuno-activated DGKALPHA inhibitors | 拜耳公司 | 2022-10-18 | — | — | CN | disclosed |
| CN-1244576-C | Compound (I) | ASTRAZENECA AB (SE) | 2006-03-08 | — | — | CN | disclosed |
| CN-1660839-A | Chemical compounds | ASTRAZENECA AB (SE) | 2005-08-31 | — | — | CN | disclosed |
| WO-2005025498-A2 | SUBSTITUTED ACETANILIDES AND BENZAMIDES FOR THE TREATMENT OF ASTHMA AND PULMONARY INFLAMMATION | CORUS PHARMA (US) | 2005-03-24 | — | — | WO | disclosed |
| CN-1433411-A | Compound (I) | ASTRAZENECA AB (SE) | 2003-07-30 | — | — | CN | disclosed |
| EP-1189886-A1 | ETHANESULFONYL-PIPERIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-03-27 | — | — | EP | disclosed |
| EP-1086073-A1 | METHOD FOR PREPARING ALKOXYAMINES FROM NITROXIDES | Elf Atochem S.A. (FR) | 2001-03-28 | — | — | EP | disclosed |
| WO-2000075109-A1 | ETHANESULFONYL-PIPERIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2000-12-14 | — | — | WO | disclosed |
| WO-2000061544-A1 | METHOD FOR PREPARING ALKOXYAMINES FROM NITROXIDES | ELF ATOCHEM S.A. (FR) | 2000-10-19 | — | — | WO | disclosed |