Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | HTR2C | P28335 | 3/20 | 0.42 |
| ▸ | RBP4 | P02753 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | PNMT | P11086 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL27696263 | 0.90 | GAA (0.47) | GAATDP1HTR2CRBP4KDM4E | |
| SCHEMBL10921603 | 0.80 | ABCB1 (0.45) | GAAKDM4EALDH1A1OPRM1OPRK1 | |
| SCHEMBL10375596 | 0.77 | HRH3 (0.43) | HTR2CKDM4EALDH1A1OPRM1OPRK1 | |
| SCHEMBL10761904 | 0.77 | HRH3 (0.43) | ALDH1A1OPRM1OPRK1HRH3LMNA | |
| SCHEMBL10375490 | 0.77 | HRH3 (0.43) | OPRM1OPRK1HRH3 | |
| SCHEMBL10376883 | 0.77 | HRH3 (0.43) | ALDH1A1OPRM1OPRK1HRH3LMNA | |
| SCHEMBL10375779 | 0.77 | HRH3 (0.43) | KDM4EALDH1A1OPRM1OPRK1HRH3 | |
| Hydrochloric Acid SCHEMBL10377530 | 0.76 | HRH3 (0.42) | HTR2CALDH1A1OPRM1OPRK1HRH3 | |
| SCHEMBL22462957 | 0.76 | GAA (0.51) | GAATDP1HTR2CRBP4HCRTR1 | |
| Hydrochloric Acid SCHEMBL10375953 | 0.76 | HRH3 (0.42) | HTR2CALDH1A1OPRM1OPRK1HRH3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0187711-B1 | OCTAHYDROINDOLIZINE COMPOUNDS USEFUL AS ANALGESICS | McNeilab, Inc. (US) | 1990-08-29 | — | — | EP | claimed |
| EP-0187711-A2 | Octahydroindolizine compounds useful as analgesics | McNeilab, Inc. (US) | 1986-07-16 | — | — | EP | claimed |
| EP-0187711-B1 | OCTAHYDROINDOLIZINE COMPOUNDS USEFUL AS ANALGESICS | McNeilab, Inc. (US) | 1990-08-29 | — | — | EP | disclosed |
| US-4582836-A | Octahydroindolizine compounds useful as analgesics | MCNEILAB, INC. (US) | 1986-04-15 | — | — | US | disclosed |