Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 5/20 | 0.89 |
| ▸ | FNTA | P49354 | 5/20 | 0.40 |
| ▸ | FNTB | P49356 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8956844 | 1.00 | TACR1 (0.89) | TACR1FNTAFNTBMEN1CYP3A4 | |
| Dapitant SCHEMBL121135 | 0.94 | TACR1 (1.00) | TACR1FNTAFNTBMEN1CYP3A4 | |
| Dapitant SCHEMBL6908668 | 0.94 | TACR1 (1.00) | TACR1FNTAFNTBMEN1CYP3A4 | |
| Dapitant SCHEMBL30695498 | 0.94 | TACR1 (1.00) | TACR1FNTAFNTBMEN1CYP3A4 | |
| Dapitant SCHEMBL13575759 | 0.94 | TACR1 (1.00) | TACR1FNTAFNTBMEN1CYP3A4 | |
| Dapitant SCHEMBL7582571 | 0.94 | TACR1 (1.00) | TACR1FNTAFNTBMEN1CYP3A4 | |
| Dapitant SCHEMBL7768046 | 0.94 | TACR1 (1.00) | TACR1FNTAFNTBMEN1CYP3A4 | |
| Dapitant SCHEMBL6437147 | 0.94 | TACR1 (1.00) | TACR1FNTAFNTBMEN1CYP3A4 | |
| Dapitant SCHEMBL8543936 | 0.94 | TACR1 (1.00) | TACR1FNTAFNTBMEN1CYP3A4 | |
| Dapitant SCHEMBL14071561 | 0.94 | TACR1 (1.00) | TACR1FNTAFNTBMEN1CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0635003-B1 | PERHYDROISOINDOLE DERIVATIVES AS P SUBSTANCE ANTAGONISTS | RHONE POULENC RORER SA (FR) | 1998-06-17 | — | — | EP | claimed |
| US-5484804-A | Perhydroisoindole derivatives as antagonists of substance P | RHONE-POULENC RORER S.A. (FR) | 1996-01-16 | — | — | US | claimed |
| US-5484804-A | Perhydroisoindole derivatives as antagonists of substance P | RHONE-POULENC RORER S.A. (FR) | 1996-01-16 | — | — | US | disclosed |