Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 4/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5042461 | 0.76 | CYP1A2 (0.47) | PKMCYP1A2CYP2C19KMT2AALDH1A1 | |
| SCHEMBL5041467 | 0.69 | CYP1A2 (0.38) | PKMCYP1A2CYP2C19KMT2AALDH1A1 | |
| SCHEMBL5033957 | 0.65 | ALDH1A1 (0.38) | PKMCYP1A2CYP2C19KMT2AALDH1A1 | |
| SCHEMBL6021711 | 0.65 | KMT2A (0.43) | KMT2APOLBMAPTMEN1GAA | |
| SCHEMBL14278707 | 0.63 | SMN1; SMN2 (0.37) | PKMCYP1A2CYP2C19KMT2AALDH1A1 | |
| SCHEMBL5038310 | 0.63 | SMN1; SMN2 (0.37) | PKMCYP1A2CYP2C19KMT2AALDH1A1 | |
| SCHEMBL5033952 | 0.63 | RAB9A (0.46) | PKMCYP1A2CYP2C19KMT2AALDH1A1 | |
| SCHEMBL5041304 | 0.62 | RAB9A (0.38) | PKMCYP1A2CYP2C19KMT2AALDH1A1 | |
| SCHEMBL5038166 | 0.60 | ALDH1A1 (0.41) | CYP1A2CYP2C19ALDH1A1POLBHPGD | |
| SCHEMBL17513526 | 0.59 | ALDH1A1 (0.40) | CYP1A2CYP2C19CYP2C9KMT2AALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1660487-B1 | PYRROLE COMPOSITIONS USEFUL AS INHIBITORS OF C-MET | VERTEX PHARMA (US) | 2008-03-19 | — | — | EP | disclosed |
| EP-1660487-A1 | PYRROLE COMPOSITIONS USEFUL AS INHIBITORS OF C-MET | Vertex Pharmaceuticals Incorporated (US) | 2006-05-31 | — | — | EP | disclosed |
| WO-2005016920-A1 | PYRROLE COMPOSITIONS USEFUL AS INHIBITORS OF C-MET | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2005-02-24 | — | — | WO | disclosed |