Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.76 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.76 |
| ▸ | OPRD1 | P41143 | 10/20 | 0.58 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.49 |
| ▸ | HTR3B | O95264 | 1/20 | 0.49 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.49 |
| ▸ | HTR3A | P46098 | 1/20 | 0.49 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.49 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.48 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | BCL2 | P10415 | 1/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8122955 | 0.92 | OPRD1 (0.65) | CYP19A1CYP2D6OPRD1OPRM1MEN1 | |
| SCHEMBL1137956 | 0.87 | CYP2D6 (1.00) | CYP19A1CYP2D6OPRD1OPRM1MEN1 | |
| SCHEMBL1741596 | 0.86 | MEN1 (0.72) | CYP19A1CYP2D6OPRD1OPRM1MEN1 | |
| SCHEMBL11206567 | 0.85 | OPRD1 (0.58) | CYP19A1CYP2D6OPRD1OPRM1MEN1 | |
| SCHEMBL1980107 | 0.82 | CYP2D6 (0.66) | CYP19A1CYP2D6OPRD1OPRM1MEN1 | |
| Norchlorcyclizine SCHEMBL588655 | 0.81 | CYP2D6 (0.86) | CYP19A1CYP2D6OPRD1OPRM1MEN1 | |
| Norchlorcyclizine SCHEMBL6556514 | 0.81 | CYP2D6 (0.86) | CYP19A1CYP2D6OPRD1OPRM1MEN1 | |
| Norchlorcyclizine SCHEMBL467086 | 0.81 | CYP2D6 (0.86) | CYP19A1CYP2D6OPRD1OPRM1MEN1 | |
| Norchlorcyclizine SCHEMBL588155 | 0.80 | CYP2D6 (0.83) | CYP19A1CYP2D6OPRD1OPRM1MEN1 | |
| Norchlorcyclizine SCHEMBL4649874 | 0.80 | CYP2D6 (0.83) | CYP19A1CYP2D6OPRD1OPRM1MEN1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5703071-A | Tropolone derivatives and pharmaceutical composition thereof for preventing and treating ischemic diseases | PHARMACIA & UPJOHN COMPANY (US) | 1997-12-30 | — | — | US | disclosed |
| EP-0546102-B1 | TROPOLONE DERIVATIVES AND PHARMACEUTICAL COMPOSITION THEREOF FOR PREVENTING AND TREATING ISCHEMIC DISEASES | UPJOHN CO (US) | 1997-10-15 | — | — | EP | disclosed |
| US-5594144-A | TREATING CEREBROVASCULAR AND CARDIOVASCULAR DISORDERS | THE UPJOHN COMPANY (US) | 1997-01-14 | — | — | US | disclosed |
| EP-0546102-A1 | TROPOLONE DERIVATIVES AND PHARMACEUTICAL COMPOSITION THEREOF FOR PREVENTING AND TREATING ISCHEMIC DISEASES. | UPJOHN CO (US) | 1993-06-16 | — | — | EP | disclosed |
| WO-1992004338-A1 | TROPOLONE DERIVATIVES AND PHARMACEUTICAL COMPOSITION THEREOF FOR PREVENTING AND TREATING ISCHEMIC DISEASES | THE UPJOHN COMPANY (US) | 1992-03-19 | — | — | WO | disclosed |