Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY14 | Q15391 | 14/20 | 0.57 |
| ▸ | TMEM97 | Q5BJF2 | 5/20 | 0.57 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | TSPO | P30536 | 1/20 | 0.57 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.56 |
| ▸ | HTR1A | P08908 | 2/20 | 0.53 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.53 |
| ▸ | DRD5 | P21918 | 2/20 | 0.53 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.53 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.53 |
| ▸ | DRD3 | P35462 | 2/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
| ▸ | PDE2A | O00408 | 1/20 | 0.53 |
| ▸ | PDE5A | O76074 | 1/20 | 0.53 |
| ▸ | EGFR | P00533 | 1/20 | 0.53 |
| ▸ | INSR | P06213 | 1/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL2927420 | 0.87 | TMEM97 (0.47) | P2RY14TMEM97SIGMAR1CYP2C9TSPO | |
| SCHEMBL2934669 | 0.80 | P2RY14 (0.56) | P2RY14TMEM97SIGMAR1CYP2C9TSPO | |
| SCHEMBL2932010 | 0.79 | P2RY14 (0.56) | P2RY14TMEM97SIGMAR1CYP2C9TSPO | |
| SCHEMBL2930702 | 0.73 | P2RY14 (0.62) | P2RY14TMEM97SIGMAR1CYP2C9TSPO | |
| SCHEMBL3757976 | 0.73 | P2RY14 (0.62) | P2RY14TMEM97SIGMAR1CYP2C9TSPO | |
| SCHEMBL3752857 | 0.73 | P2RY14 (0.62) | P2RY14TMEM97SIGMAR1CYP2C9TSPO | |
| SCHEMBL29691885 | 0.73 | P2RY14 (1.00) | P2RY14TMEM97SIGMAR1CYP2C9TSPO | |
| SCHEMBL22918399 | 0.72 | P2RY14 (1.00) | P2RY14TMEM97SIGMAR1CYP2C9TSPO | |
| SCHEMBL3761498 | 0.72 | P2RY14 (0.61) | P2RY14TMEM97SIGMAR1CYP2C9TSPO | |
| SCHEMBL2934201 | 0.72 | P2RY14 (0.63) | P2RY14TMEM97SIGMAR1CYP2C9TSPO |
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-2229373-A1 | SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY | Merck Frosst Canada Ltd. (CA) | 2010-09-22 | — | — | EP | disclosed |
| WO-2009070873-A1 | SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY | MERCK FROSST CANADA LTD. (CA) | 2009-06-11 | — | — | WO | disclosed |