Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | ACP3 | P15309 | 1/20 | 0.45 |
| ▸ | METAP2 | P50579 | 1/20 | 0.43 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1420697 | 0.79 | TDP1 (0.53) | CYP1A2CYP2D6CYP2C19MTNR1ATDP1 | |
| SCHEMBL28402183 | 0.77 | CYP1A2 (0.51) | CYP1A2CYP2D6CYP2C19MTNR1ATDP1 | |
| SCHEMBL6029284 | 0.73 | ALDH1A1 (0.55) | CYP1A2CYP2D6CYP2C19TDP1MEN1 | |
| SCHEMBL66670 | 0.73 | TDP1 (0.69) | CYP1A2MTNR1ATDP1MEN1KMT2A | |
| SCHEMBL22651839 | 0.72 | CYP1A2 (0.59) | CYP1A2CYP2D6CYP2C19MTNR1ATDP1 | |
| SCHEMBL18942412 | 0.72 | TDP1 (0.62) | CYP1A2CYP2D6CYP2C19MTNR1ATDP1 | |
| SCHEMBL4965935 | 0.72 | CYP1A2 (0.64) | CYP1A2CYP2D6CYP2C19MTNR1ATDP1 | |
| SCHEMBL11622239 | 0.72 | MEN1 (0.50) | MTNR1ATDP1MEN1KMT2AHPGD | |
| SCHEMBL25376490 | 0.72 | CYP1A2 (0.50) | CYP1A2CYP2D6CYP2C19MTNR1ATDP1 | |
| SCHEMBL15224109 | 0.72 | CYP1A2 (0.54) | CYP1A2CYP2D6CYP2C19MTNR1ATDP1 |
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-1709040-A2 | FIVE-MEMBERED HETEROCYCLIC COMPOUNDS AS INHIBITORS OF SRC FAMILY PROTEIN KINASE | Sirenade Pharmaceuticals AG (DE) | 2006-10-11 | — | — | EP | disclosed |
| WO-2005068458-A2 | FIVE-MEMBERED HETEROCYCLIC COMPOUNDS AS INHIBITORS OF SRC FAMILY PROTEIN KINASE | SIRENADE PHARMACEUTICALS AG (DE) | 2005-07-28 | — | — | WO | disclosed |