Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | USP2 | O75604 | 2/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4301735 | 1.00 | HRH3 (0.73) | HRH3CYP3A4TSHRMAPK1SLC18A3 | |
| SCHEMBL4301730 | 1.00 | HRH3 (0.73) | HRH3CYP3A4TSHRMAPK1SLC18A3 | |
| SCHEMBL4301727 | 1.00 | HRH3 (0.73) | HRH3CYP3A4TSHRMAPK1SLC18A3 | |
| SCHEMBL4292882 | 0.91 | HRH3 (0.58) | HRH3SLC18A3ALDH1A1CYP19A1MEN1 | |
| SCHEMBL4292880 | 0.91 | HRH3 (0.58) | HRH3SLC18A3ALDH1A1CYP19A1MEN1 | |
| SCHEMBL4292885 | 0.91 | HRH3 (0.58) | HRH3SLC18A3ALDH1A1CYP19A1MEN1 | |
| SCHEMBL4295497 | 0.90 | HRH3 (0.59) | HRH3CYP3A4TSHRMAPK1SLC18A3 | |
| SCHEMBL13660560 | 0.90 | HRH3 (0.59) | HRH3CYP3A4TSHRMAPK1SLC18A3 | |
| SCHEMBL10719966 | 0.87 | HRH3 (0.64) | HRH3 | |
| SCHEMBL10718703 | 0.87 | HRH3 (0.64) | HRH3 |
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 | claimed |
| WO-2002024695-A2 | OCTAHYDRO-INDOLIZINES AND QUINOLIZINES AND HEXAHYDRO-PYRROLIZINES | ORTHO MCNEIL PHARMACEUTICAL, INC. (US) | 2002-03-28 | — | — | WO | claimed |