Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | GLS | O94925 | 1/20 | 0.38 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL17138164 | 0.89 | KMT2A (0.46) | HPGDALDH1A1MEN1KMT2AACHE | |
| SCHEMBL11793851 | 0.83 | LMNA (0.56) | HPGDALDH1A1MEN1KMT2APPARG | |
| SCHEMBL11800597 | 0.82 | ALDH1A1 (0.44) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL9797764 | 0.81 | LMNA (0.47) | ALDH1A1PPARGPPARAMRGPRX4RAB9A | |
| SCHEMBL27471100 | 0.81 | EPHX1 (0.44) | — | |
| SCHEMBL114036 | 0.80 | PRSS1 (0.46) | ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2 | |
| SCHEMBL6556364 | 0.80 | KMT2A (0.48) | HPGDALDH1A1MEN1KMT2AESR1 | |
| SCHEMBL15763906 | 0.79 | MEN1 (0.52) | HPGDALDH1A1MEN1KMT2AESR1 | |
| SCHEMBL27570623 | 0.78 | KMT2A (0.44) | HPGDALDH1A1MEN1KMT2AESR1 | |
| SCHEMBL5634217 | 0.77 | ESR1 (0.49) | HPGDALDH1A1MEN1KMT2AESR1 |
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-1077942-A1 | CARBOXY SUBSTITUTED CARBOXAMIDE DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONISTS | Aventis Pharmaceuticals Inc. (US) | 2001-02-28 | — | — | EP | disclosed |
| WO-1999059972-A1 | CARBOXY SUBSTITUTED CARBOXAMIDE DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONISTS | AVENTIS PHARMACEUTICALS INC. (US) | 1999-11-25 | — | — | WO | disclosed |