Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.47 |
| ▸ | MAPT | P10636 | 5/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.47 |
| ▸ | MMP13 | P45452 | 6/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | PDE2A | O00408 | 1/20 | 0.40 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5669919 | 0.90 | MMP13 (0.43) | MAPTMMP13ALDH1A1LMNAMMP1 | |
| SCHEMBL2174194 | 0.84 | PTPRB (0.51) | RAB9AMAPTNPC1HSP90AA1MMP13 | |
| SCHEMBL2174676 | 0.80 | MAPT (0.48) | RAB9AMAPTNPC1HSP90AA1ALDH1A1 | |
| SCHEMBL5668327 | 0.79 | RAB9A (0.53) | RAB9AMAPTNPC1HSP90AA1MMP13 | |
| SCHEMBL18003076 | 0.77 | MAPT (0.76) | RAB9AMAPTNPC1HSP90AA1MMP13 | |
| SCHEMBL2172774 | 0.74 | PTPN1 (0.46) | ALDH1A1LMNACYP1A2CYP2C19 | |
| SCHEMBL4562630 | 0.73 | SMN1; SMN2 (0.42) | MMP13ALDH1A1SMN1; SMN2MMP1CYP1A2 | |
| SCHEMBL15349050 | 0.73 | RAB9A (0.55) | RAB9AMAPTNPC1HSP90AA1MMP13 | |
| SCHEMBL4383724 | 0.72 | ALDH1A1 (0.43) | MAPTALDH1A1SMN1; SMN2GAACYP1A2 | |
| SCHEMBL4392406 | 0.72 | ALDH1A1 (0.43) | MAPTALDH1A1SMN1; SMN2GAACYP1A2 |
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-1730128-A1 | ANAPLASTIC LYMPHOMA KINASE MODULATORS AND METHODS OF USE | Exelixis, Inc. (US) | 2006-12-13 | — | — | EP | disclosed |
| WO-2005097765-A1 | ANAPLASTIC LYMPHOMA KINASE MODULATORS AND METHODS OF USE | EXELIXIS, INC. (US) | 2005-10-20 | — | — | WO | disclosed |