Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 9/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 9/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.44 |
| ▸ | HTR2C | P28335 | 4/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | HTR2B | P41595 | 2/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 3/20 | 0.42 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.42 |
| ▸ | HTR3B | O95264 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL8313290 | 0.95 | OPRM1 (0.49) | OPRM1OPRD1ABCB11KCNH2OPRK1 | |
| SCHEMBL13437760 | 0.81 | OPRM1 (0.56) | OPRM1OPRD1OPRK1TP53THRB | |
| SCHEMBL8314573 | 0.79 | OPRD1 (0.58) | OPRM1OPRD1ABCB11KCNH2OPRK1 | |
| SCHEMBL8316059 | 0.79 | OPRM1 (0.49) | OPRM1OPRD1ABCB11KCNH2OPRK1 | |
| SCHEMBL14415620 | 0.79 | OPRD1 (0.65) | OPRM1OPRD1ABCB11KCNH2OPRK1 | |
| Hydrochloric Acid SCHEMBL30055362 | 0.78 | HTR2C (0.39) | OPRM1OPRD1OPRK1HTR2CHTR2A | |
| Hydrochloric Acid SCHEMBL27166047 | 0.78 | HTR2C (0.39) | OPRM1OPRD1OPRK1HTR2CHTR2A | |
| SCHEMBL10460871 | 0.77 | OPRD1 (0.65) | OPRM1OPRD1ABCB11KCNH2OPRK1 | |
| SCHEMBL2457390 | 0.77 | OPRD1 (0.61) | OPRM1OPRD1ABCB11KCNH2OPRK1 | |
| Bromide SCHEMBL10598951 | 0.75 | OPRD1 (0.59) | OPRM1OPRD1ABCB11KCNH2OPRK1 |
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-0536419-B1 | TRICYCLIC TRIAZOLE DERIVATIVES, PRODUCTION AND USE THEREOF | TORAY INDUSTRIES (JP) | 1999-10-13 | — | — | EP | disclosed |
| US-5683998-A | ANTIINFLAMMATORY AGENTS, ANTIALLERGENS, ANTIPAF AGENTS | TORAY INDUSTRIES, INC. (JP) | 1997-11-04 | — | — | US | disclosed |
| EP-0536419-A1 | TRICYCLIC TRIAZOLE DERIVATIVE, PRODUCTION THEREOF, AND USE THEREOF | TORAY INDUSTRIES, INC. (JP) | 1993-04-14 | — | — | EP | disclosed |