Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.58 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL4290125 | 1.00 | HRH3 (0.58) | HRH3CYP19A1CHRNA7CYP2C9CYP3A4 | |
| SCHEMBL4290121 | 1.00 | HRH3 (0.58) | HRH3CYP19A1CHRNA7CYP2C9CYP3A4 | |
| SCHEMBL4290117 | 1.00 | HRH3 (0.58) | HRH3CYP19A1CHRNA7CYP2C9CYP3A4 | |
| Hydrochloric Acid SCHEMBL10721752 | 0.98 | HRH3 (0.57) | HRH3CYP19A1CHRNA7CYP2C9CYP3A4 | |
| Hydrochloric Acid SCHEMBL4294092 | 0.98 | HRH3 (0.57) | HRH3CYP19A1CHRNA7CYP2C9CYP3A4 | |
| Hydrochloric Acid SCHEMBL10721758 | 0.98 | HRH3 (0.57) | HRH3CYP19A1CHRNA7CYP2C9CYP3A4 | |
| SCHEMBL4290379 | 0.93 | HRH3 (0.51) | HRH3CYP19A1CHRNA7CYP2C9CYP3A4 | |
| SCHEMBL9688425 | 0.88 | TSHR (0.46) | HRH3CYP19A1CHRNA7CYP2C9CYP3A4 | |
| SCHEMBL9688416 | 0.88 | TSHR (0.46) | HRH3CYP19A1CHRNA7CYP2C9CYP3A4 | |
| SCHEMBL4296694 | 0.88 | TSHR (0.46) | HRH3CYP19A1CHRNA7CYP2C9CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1326863-A2 | OCTAHYDRO-INDOLIZINES AND QUINOLIZINES AND HEXAHYDRO-PYRROLIZINES | Ortho-McNeil Pharmaceutical, Inc. (US) | 2003-07-16 | — | — | EP | disclosed |
| WO-2002024695-A2 | OCTAHYDRO-INDOLIZINES AND QUINOLIZINES AND HEXAHYDRO-PYRROLIZINES | ORTHO MCNEIL PHARMACEUTICAL, INC. (US) | 2002-03-28 | — | — | WO | disclosed |