Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 5/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.40 |
| ▸ | GPR142 | Q7Z601 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NTRK1 | P04629 | 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 | |
|---|---|---|---|---|
| SCHEMBL16003986 | 0.87 | ALDH1A1 (0.42) | KMT2AMEN1HTTCHRM5CHRM1 | |
| SCHEMBL16003985 | 0.87 | ATM (0.43) | KMT2AMEN1HTTCHRM5CHRM1 | |
| SCHEMBL16003990 | 0.86 | CHRM5 (0.43) | KMT2AMEN1HTTCHRM5CHRM1 | |
| SCHEMBL16003993 | 0.85 | GAA (0.51) | KMT2AMEN1HTTCHRM5CHRM1 | |
| SCHEMBL16003994 | 0.85 | GPR142 (0.60) | CHRM5CHRM1ALDH1A1GPR142 | |
| SCHEMBL16004317 | 0.78 | GPR142 (0.61) | KMT2AMEN1CHRM5CHRM1ALDH1A1 | |
| SCHEMBL16004254 | 0.76 | PIK3CA (0.47) | KMT2AMEN1HTTLMNAALDH1A1 | |
| SCHEMBL16004091 | 0.76 | ALDH1A1 (0.48) | KMT2AMEN1LMNAALDH1A1GPR142 | |
| SCHEMBL16004308 | 0.73 | ABCB1 (0.48) | KMT2AMEN1HTTALDH1A1GPR142 | |
| SCHEMBL16004303 | 0.73 | HPGD (0.49) | KMT2ALMNASMN1; SMN2 |
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-2014133414-A2 | HETEROCYCLIC TGR5 BILE ACID RECEPTOR AGONISTS, PHARMACEUTICAL COMPOSITION, METHODS FOR THE PRODUCTION AND USE THEREOF | АЛЛА ХЕМ ЛЛС (US) | 2014-09-04 | — | — | WO | disclosed |