Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 3/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.48 |
| ▸ | LTA4H | P09960 | 2/20 | 0.46 |
| ▸ | MMEL1 | Q495T6 | 1/20 | 0.44 |
| ▸ | ELANE | P08246 | 1/20 | 0.44 |
| ▸ | ACE | P12821 | 1/20 | 0.44 |
| ▸ | PREP | P48147 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 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 | |
|---|---|---|---|---|
| SCHEMBL372167 | 1.00 | ALDH1A1 (0.51) | ALDH1A1CYP3A4TSHRADORA3ADORA2A | |
| SCHEMBL371906 | 0.88 | ALDH1A1 (0.55) | ALDH1A1CYP3A4TSHRADORA3ADORA2A | |
| SCHEMBL378574 | 0.88 | ALDH1A1 (0.55) | ALDH1A1CYP3A4TSHRADORA3ADORA2A | |
| SCHEMBL16692005 | 0.80 | MMEL1 (0.54) | ALDH1A1CYP3A4TSHRADORA3ADORA2A | |
| SCHEMBL18065507 | 0.80 | MMEL1 (0.54) | ALDH1A1CYP3A4TSHRADORA3ADORA2A | |
| SCHEMBL6017607 | 0.78 | ACE (0.54) | ALDH1A1CYP3A4TSHRADORA3ADORA2A | |
| SCHEMBL3104909 | 0.78 | LTA4H (0.48) | ALDH1A1CYP3A4TSHRADORA3ADORA2A | |
| SCHEMBL14842341 | 0.78 | CTRB1 (0.52) | ALDH1A1CYP3A4TSHRELANECYP2C9 | |
| SCHEMBL14842340 | 0.78 | CTRB1 (0.52) | ALDH1A1CYP3A4TSHRELANECYP2C9 | |
| SCHEMBL14842339 | 0.78 | CTRB1 (0.52) | ALDH1A1CYP3A4TSHRELANECYP2C9 |
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-1874759-A4 | C-MET MODULATORS AND METHODS OF USE | EXELIXIS INC (US) | 2009-07-15 | — | — | EP | disclosed |
| EP-1874759-A1 | C-MET MODULATORS AND METHODS OF USE | Exelixis, Inc. (US) | 2008-01-09 | — | — | EP | disclosed |
| WO-2006108059-A1 | C-MET MODULATORS AND METHODS OF USE | EXELIXIS, INC. (US) | 2006-10-12 | — | — | WO | disclosed |