Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SKP2 | Q13309 | 1/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.44 |
| ▸ | CYP4F11 | Q9HBI6 | 1/20 | 0.44 |
| ▸ | CYP4F12 | Q9HCS2 | 1/20 | 0.44 |
| ▸ | IGF1R | P08069 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8338503 | 0.88 | SIGMAR1 (0.47) | SKP2SIGMAR1CYP3A4CYP2D6NPSR1 | |
| SCHEMBL9177318 | 0.83 | SIGMAR1 (0.62) | SKP2SIGMAR1CYP2D6SMN1; SMN2GLA | |
| SCHEMBL82284 | 0.82 | IGF1R (0.44) | SKP2SIGMAR1CYP3A4CYP2D6NPSR1 | |
| SCHEMBL80740 | 0.82 | SKP2 (0.42) | SKP2SIGMAR1CYP3A4CYP2D6NPSR1 | |
| SCHEMBL8500210 | 0.82 | PNMT (0.52) | SKP2SIGMAR1CYP3A4CYP2D6NPSR1 | |
| SCHEMBL5838115 | 0.81 | SKP2 (0.68) | SKP2CYP3A4CYP2C9CYP2D6NPC1 | |
| SCHEMBL14668134 | 0.79 | GRIN2D (0.45) | SKP2SIGMAR1CYP3A4CYP2D6NPSR1 | |
| SCHEMBL13981318 | 0.79 | SIGMAR1 (0.51) | SIGMAR1CYP2D6CYP1A2CYP2C19 | |
| SCHEMBL1755262 | 0.79 | MAPT (0.49) | SIGMAR1CYP3A4HPGDNPSR1CYP1A2 | |
| SCHEMBL9342371 | 0.78 | SKP2 (0.46) | SKP2SIGMAR1NPC1HPGDRAB9A |
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-3150705-A1 | METHOD FOR INDUCING MYOCARDIAL DIFFERENTIATION OF PLURIPOTENT STEM CELLS USING LOW-MOLECULAR COMPOUND | Kyoto University (JP) | 2017-04-05 | — | — | EP | disclosed |
| EP-2308872-A1 | Heterocyclic derivatives as modulators of ion channels | Vertex Pharmaceuticals Incorporated (US) | 2011-04-13 | — | — | EP | disclosed |