Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PBRM1 | Q86U86 | 2/20 | 0.49 |
| ▸ | CFTR | P13569 | 3/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.41 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.41 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL377150 | 0.73 | CFTR (0.67) | PBRM1CFTRKDM4ECSNK2A2CSNK2B | |
| SCHEMBL29551347 | 0.73 | CFTR (0.67) | PBRM1CFTRKDM4ECSNK2A2CSNK2B | |
| Hydrochloric Acid SCHEMBL29766716 | 0.71 | CFTR (0.65) | PBRM1CFTRKDM4ECSNK2A2CSNK2B | |
| Hydrochloric Acid SCHEMBL9046989 | 0.71 | CFTR (0.65) | PBRM1CFTRKDM4ECSNK2A2CSNK2B | |
| Hydrochloric Acid SCHEMBL30585295 | 0.71 | CFTR (0.65) | PBRM1CFTRKDM4ECSNK2A2CSNK2B | |
| SCHEMBL6629595 | 0.69 | CFTR (0.61) | PBRM1CFTRKDM4ECSNK2A2CSNK2B | |
| Pyrazine SCHEMBL10716045 | 0.67 | CFTR (0.58) | PBRM1CFTRKDM4ECSNK2A2CSNK2B | |
| SCHEMBL10526864 | 0.66 | PBRM1 (0.67) | PBRM1PARP1KDM4EALDH1A1GLA | |
| SCHEMBL4943278 | 0.66 | PBRM1 (1.00) | PBRM1PARP1KDM4EALDH1A1GLA | |
| SCHEMBL2241035 | 0.65 | GAA (0.40) | PARP1KDM4EALDH1A1GLAGAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1443937-A1 | SUBSTITUTED 1,4-BENZODIAZEPINES AND USES THEREOF FOR THE TREATMENT OF CANCER | 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) | 2004-08-11 | — | — | EP | disclosed |
| WO-2003041715-A1 | SUBSTITUTED 1,4-BENZODIAZEPINES AND USES THEREOF FOR THE TREATMENT OF CANCER | 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) | 2003-05-22 | — | — | WO | disclosed |