Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.35 |
| ▸ | KDM4A | O75164 | 1/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11712943 | 0.90 | CYP19A1 (0.39) | HTR2ASIGMAR1KCNH2SLC6A2SLC6A4 | |
| SCHEMBL6468709 | 0.89 | HTR2A (0.47) | HTR2ASIGMAR1KCNH2CHRM2HTR1A | |
| SCHEMBL28775673 | 0.89 | SIGMAR1 (0.47) | HTR2ASIGMAR1KCNH2CHRM2HTR1A | |
| SCHEMBL6570932 | 0.87 | CYP19A1 (0.46) | SIGMAR1KCNH2CYP19A1 | |
| SCHEMBL28163887 | 0.82 | ESR1 (0.53) | HTR2ASIGMAR1KCNH2HTR1ASLC6A2 | |
| SCHEMBL10437920 | 0.79 | CYP19A1 (0.43) | HTR2AESR1ESR2CYP19A1 | |
| SCHEMBL11877259 | 0.79 | RIPK1 (0.44) | HTR2ASIGMAR1KCNH2CHRM2HTR1A | |
| SCHEMBL1170712 | 0.79 | CYP19A1 (0.40) | HTR2ASIGMAR1KCNH2SLC6A2SLC6A4 | |
| SCHEMBL6283206 | 0.78 | CYP19A1 (0.47) | HTR2ASIGMAR1KCNH2CHRM2HTR1A | |
| SCHEMBL28031202 | 0.78 | ESR1 (0.38) | ESR1ESR2 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005037797-A1 | SUBSTITUTED PYRAZOLE UREA COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | PHARMACIA CORPORATION (US) | 2005-04-28 | — | — | WO | claimed |
| US-20230220294-A1 | LUBRICANT COMPOSITION COMPRISING A 2,5-DIMERCAPTO-1,3,4-THIADIAZOLE ALKYL POLYCARBOXYLATE COMPOUND | TOTALENERGIES ONETECH (FR) | 2023-07-13 | — | — | US | disclosed |
| EP-1760095-A2 | Emulsifier for emulsion polymerization, production method of polymer emulsion and polymer emulsion | Dai-Ichi Kogyo Seiyaku Co., Ltd. (JP) | 2007-03-07 | — | — | EP | disclosed |
| US-20070049687-A1 | Emulsifier for emulsion polymerization, production method of polymer emulsion and polymer emulsion | DAI-ICHI KOGYO SEIYAKU CO., LTD. (JP) | 2007-03-01 | — | — | US | disclosed |
| EP-1404325-A2 | METHOD FOR TREATING NERVE INJURY CAUSED BY SURGERY | GUILFORD PHARMACEUTICALS INC. (US) | 2004-04-07 | — | — | EP | disclosed |
| WO-2002096420-A2 | METHOD FOR TREATING NERVE INJURY CAUSED BY SURGERY | GUILFORD PHARMACEUTICALS INC. (US) | 2002-12-05 | — | — | WO | disclosed |
| EP-0354871-B1 | Corrosion inhibition | CIBA GEIGY AG (CH) | 1993-11-24 | — | — | EP | disclosed |
| US-5176850-A | Corrosion Inhibitors | CIBA-GEIGY CORPORATION (US) | 1993-01-05 | — | — | US | disclosed |
| US-5013482-A | Ether acids | CIBA-GEIGY CORPORATION (US) | 1991-05-07 | — | — | US | disclosed |