Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | OGFRL1 | Q5TC84 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19284497 | 0.78 | ALDH1A1 (0.49) | MRGPRX4OPRM1OPRD1OPRK1OGFRL1 | |
| SCHEMBL28480511 | 0.77 | MAPT (0.63) | SMN1; SMN2ALDH1A1MAPTKDM4EKMT2A | |
| SCHEMBL19801995 | 0.74 | DDR1 (0.51) | OPRM1OPRD1OPRK1OGFRL1SMN1; SMN2 | |
| SCHEMBL6041694 | 0.74 | MAPT (0.48) | SMN1; SMN2ALDH1A1MAPTKDM4ERAB9A | |
| SCHEMBL14158144 | 0.72 | ESR1 (0.54) | ALDH1A1TP53SCN9ALIPENPC1 | |
| SCHEMBL17869278 | 0.72 | NPC1 (0.58) | OPRM1OPRD1OPRK1OGFRL1SMN1; SMN2 | |
| SCHEMBL6044419 | 0.72 | CYSLTR1 (0.49) | MRGPRX4SMN1; SMN2ALDH1A1MAPTTP53 | |
| SCHEMBL30109340 | 0.70 | LIPE (0.58) | MAPK1ALDH1A1MAPTTSHRKDM4E | |
| SCHEMBL15000524 | 0.70 | OPRM1 (0.41) | OPRM1OPRD1OPRK1OGFRL1MAPK1 | |
| SCHEMBL16775545 | 0.69 | OPRM1 (0.42) | OPRM1OPRD1OPRK1OGFRL1SMN1; 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-2017147047-A1 | FXR MODULATORS AND METHODS OF THEIR USE | ALIOS BIOPHARMA, INC. (US) | 2017-08-31 | — | — | WO | disclosed |