Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SKP2 | Q13309 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | IGF1R | P08069 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19000273 | 0.95 | SIGMAR1 (0.44) | SKP2SIGMAR1IGF1RALOX15KCNH2 | |
| SCHEMBL7640418 | 0.87 | SKP2 (0.47) | SKP2SIGMAR1NPC1HPGDMAPK1 | |
| SCHEMBL10893209 | 0.81 | SKP2 (0.50) | SKP2NPC1HPGDMAPK1HTT | |
| SCHEMBL31460200 | 0.81 | CYP4F2 (0.44) | SIGMAR1NPC1HPGDMAPK1RAB9A | |
| SCHEMBL9177318 | 0.79 | SIGMAR1 (0.62) | SKP2SIGMAR1GLASMN1; SMN2IGF1R | |
| SCHEMBL19011267 | 0.78 | IGF1R (0.39) | SIGMAR1IGF1RALOX15 | |
| SCHEMBL19000295 | 0.77 | ESR1 (0.46) | SIGMAR1IGF1RALOX15 | |
| SCHEMBL16750381 | 0.77 | CTRC (0.38) | SKP2SIGMAR1NPC1HPGDMAPK1 | |
| SCHEMBL16750366 | 0.76 | NPC1 (0.46) | NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL844393 | 0.75 | HTR1A (0.49) | SIGMAR1MAPK1HTT |
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-2017106818-A1 | SUBSTITUTED 4-PHENYL PYRIDINE COMPOUNDS AS NON-SYSTEMIC TGR5 AGONISTS | ARDELYX, INC. (US) | 2017-06-22 | — | — | WO | disclosed |