Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 6/20 | 0.40 |
| ▸ | RHOC | P08134 | 2/20 | 0.40 |
| ▸ | RHOA | P61586 | 2/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.36 |
| ▸ | RBP4 | P02753 | 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 | |
|---|---|---|---|---|
| SCHEMBL4783999 | 0.86 | KDM4E (0.50) | TACR1RHOCRHOACYP3A4TSHR | |
| SCHEMBL4781278 | 0.86 | ALDH1A1 (0.38) | KDM4EALDH1A1L3MBTL1HSP90AA1HSP90AB1 | |
| SCHEMBL4783091 | 0.86 | ALDH1A1 (0.41) | TACR1RHOCRHOAKDM4EALDH1A1 | |
| SCHEMBL4783584 | 0.85 | TRPV1 (0.46) | TRPV1KDM4EALDH1A1 | |
| SCHEMBL4782716 | 0.85 | TACR1 (0.40) | TACR1RHOCRHOATRPV1CYP3A4 | |
| SCHEMBL4784173 | 0.84 | ALDH1A1 (0.39) | TACR1RHOCRHOAKDM4EALDH1A1 | |
| SCHEMBL4781699 | 0.83 | TACR1 (0.40) | TACR1RHOCRHOATRPV1CYP3A4 | |
| SCHEMBL4783560 | 0.82 | SMN1; SMN2 (0.45) | CYP3A4KDM4EALDH1A1L3MBTL1 | |
| SCHEMBL4783251 | 0.79 | MAPT (0.41) | TSHRKDM4EALDH1A1L3MBTL1HSP90AA1 | |
| SCHEMBL14160364 | 0.77 | TACR1 (0.39) | TACR1CYP3A4TSHRUSP2KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008067222-A1 | HETEROCYCLIC MODULATORS OF TGR5 | KALYPSYS, INC. (US) | 2008-06-05 | — | — | WO | disclosed |