Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 4/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | HTR2C | P28335 | 3/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL8800284 | 1.00 | OPRD1 (0.41) | OPRD1SIGMAR1HTR2CHTR2BPARP1 | |
| SCHEMBL8799968 | 0.78 | OPRM1 (0.35) | OPRD1OPRM1OPRK1 | |
| SCHEMBL9050223 | 0.78 | HTR2C (0.43) | HTR2COPRM1AKR1B1KDM1AHTR2A | |
| SCHEMBL1669091 | 0.76 | KDM1A (0.36) | OPRD1SIGMAR1HTR2CHTR2BOPRM1 | |
| SCHEMBL8796555 | 0.74 | AKR1B1 (0.46) | OPRD1SIGMAR1HTR2CHTR2BOPRM1 | |
| SCHEMBL14530123 | 0.74 | OPRD1 (0.41) | OPRD1SIGMAR1OPRM1AKR1B1KCNH2 | |
| SCHEMBL14530127 | 0.74 | OPRD1 (0.38) | OPRD1SIGMAR1OPRM1AKR1B1KDM1A | |
| SCHEMBL14530307 | 0.74 | OPRD1 (0.41) | OPRD1SIGMAR1OPRM1AKR1B1KCNH2 | |
| SCHEMBL9055539 | 0.73 | AKR1B1 (0.46) | AKR1B1 | |
| SCHEMBL14529886 | 0.71 | OPRM1 (0.45) | SIGMAR1OPRM1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1996011934-A1 | TRICYCLIC SPIRO COMPOUNDS PROCESS FOR THEIR PREPARATION AND THEIR USE AS 5HT1D RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1996-04-25 | — | — | WO | disclosed |