Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | GPX4 | P36969 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL275438 | 0.88 | NR1H4 (0.65) | NR1H4MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL274678 | 0.82 | NR1H4 (0.63) | NR1H4KDM4EALDH1A1HPGDNPC1 | |
| SCHEMBL275743 | 0.82 | NR1H4 (0.67) | NR1H4MEN1KMT2ANOTUMKDM4E | |
| SCHEMBL275517 | 0.78 | NR1H4 (0.71) | NR1H4MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL272586 | 0.78 | NR1H4 (0.61) | NR1H4KDM4EALDH1A1LMNACYP3A4 | |
| SCHEMBL5731188 | 0.77 | TRPV1 (0.49) | NR1H4KMT2AKDM4EALDH1A1HPGD | |
| SCHEMBL273929 | 0.77 | NR1H4 (0.61) | NR1H4TRPV1CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL274792 | 0.77 | TRPV1 (0.57) | NR1H4KDM4EALDH1A1HPGDLMNA | |
| SCHEMBL5731865 | 0.77 | TRPV1 (0.61) | NR1H4KDM4EALDH1A1LMNANPC1 | |
| SCHEMBL274721 | 0.77 | NR1H4 (0.51) | NR1H4MEN1KMT2AKDM4EALDH1A1 |
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-1692136-A2 | AZEPINOINDOLE DERIVATIVES AS PHARMACEUTICAL AGENTS | X-Ceptor Therapeutics, Inc. (US) | 2006-08-23 | — | — | EP | disclosed |
| WO-2005056554-A2 | AZEPINOINDOLE DERIVATIVES AS PHARMACEUTICAL AGENTS | EXELIXIS, INC. (US) | 2005-06-23 | — | — | WO | disclosed |