Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.50 |
| ▸ | TSHR | P16473 | 5/20 | 0.42 |
| ▸ | USP2 | O75604 | 8/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.37 |
| ▸ | HTR3B | O95264 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.37 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.36 |
| ▸ | TP53 | P04637 | 4/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16876839 | 0.85 | HSD17B10 (0.35) | HSD17B10TSHRUSP2ALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL8808669 | 0.84 | HSD17B10 (0.35) | HSD17B10TSHRUSP2ALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL7841330 | 0.82 | ADRB1 (0.44) | HSD17B10OPRM1ADRB1MAPT | |
| SCHEMBL16876824 | 0.79 | CYP11B2 (0.34) | HSD17B10TSHRSIGMAR1DRD2 | |
| SCHEMBL7706497 | 0.76 | OPRL1 (0.54) | HSD17B10TSHRALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL16876890 | 0.76 | ADRB1 (0.33) | HSD17B10ADRB1 | |
| SCHEMBL15759065 | 0.74 | SIGMAR1 (0.50) | TSHRCYP2D6SIGMAR1OPRM1DRD2 | |
| SCHEMBL4355371 | 0.72 | HSD17B10 (0.57) | HSD17B10TSHRUSP2CYP2D6ALDH1A1 | |
| SCHEMBL16876780 | 0.72 | OPRM1 (0.34) | OPRM1TP53LMNA | |
| SCHEMBL5555955 | 0.70 | SLC6A9 (0.59) | OPRM1 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0997464-B1 | 1,3,8-Triazaspiro[4,5] decanone compounds as orl1-receptor agonists | PFIZER (US) | 2005-02-16 | — | — | EP | disclosed |
| US-6465478-B1 | 1,3,8-Triuazaspiro(4,5)decanone compounds as ORL1-receptor agonists | PFIZER INC. | 2002-10-15 | — | — | US | disclosed |
| EP-0997464-A1 | 1,3,8-Triazaspiro[4,5] decanone compounds as orl1-receptor agonists | PFIZER INC. (US) | 2000-05-03 | — | — | EP | disclosed |
| WO-2000023444-A1 | 5,7-DISUBSTITUTED-4-AMINOPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS | ABBOTT LABORATORIES (US) | 2000-04-27 | — | — | WO | disclosed |
| EP-0696280-B1 | SUBSTITUTED PYRROLIDIN-3-YL-ALKYL-PIPERIDINES USEFUL AS TACHYKININ ANTAGONISTS | MERRELL PHARMA INC (US) | 1997-09-24 | — | — | EP | disclosed |
| US-5661160-A | ADMINISTERING AN ANTITUSSIVE AGENT FOR TREATING COUGH; TACHYKININ ANTAGONISM, SUBSTANCE P AND NEUROKININ A ANTAGONISM | MERRELL PHARMACEUTICALS INC. (US) | 1997-08-26 | — | — | US | disclosed |
| US-5648366-A | TACHYKININ ANTAGONISTS USEFUL IN TREATING ASTHMA | MERRELL PHARMACEUTICALS INC. (US) | 1997-07-15 | — | — | US | disclosed |
| US-5635510-A | TACHYKININ (ESPECIALLY SUBSTANCE P AND NEUROKININ A) ANTAGONISTS; ANTIINFLAMMATORY AGENTS, ANALGESICS; NERVOUS SYSTEM DISORDERS; BRONCHODILATOR AGENTS | MERRELL PHARMACEUTICALS INC. (US) | 1997-06-03 | — | — | US | disclosed |
| EP-0696280-A1 | SUBSTITUTED PYRROLIDIN-3-YL-ALKYL-PIPERIDINES USEFUL AS TACHYKININ ANTAGONISTS | MERRELL DOW PHARMA (US) | 1996-02-14 | — | — | EP | disclosed |
| WO-1994026735-A1 | SUBSTITUTED PYRROLIDIN-3-YL-ALKYL-PIPERIDINES USEFUL AS TACHYKININ ANTAGONISTS | MERRELL DOW PHARMACEUTICALS INC. (US) | 1994-11-24 | — | — | WO | disclosed |