Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 1/20 | 0.45 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.38 |
| ▸ | DVL1 | O14640 | 2/20 | 0.38 |
| ▸ | DVL3 | Q92997 | 2/20 | 0.38 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12826280 | 0.89 | SMO (0.43) | SMOKDM4EALDH1A1ACSS2HTR4 | |
| SCHEMBL16230012 | 0.80 | EGFR (0.37) | SMOCNR1KDM4EALDH1A1ACSS2 | |
| SCHEMBL13708854 | 0.79 | LMNA (0.39) | SMODVL1DVL3HTR4 | |
| SCHEMBL1059926 | 0.78 | SMO (0.47) | SMO | |
| SCHEMBL10314248 | 0.77 | SMO (0.64) | SMOACSS2HTR4 | |
| Hydrochloric Acid SCHEMBL1060009 | 0.76 | SMO (0.63) | SMOACSS2HTR4 | |
| SCHEMBL11976393 | 0.73 | SMO (0.60) | SMOCNR1KDM4EALDH1A1ACSS2 | |
| SCHEMBL10316154 | 0.73 | SMO (0.60) | SMOCNR1KDM4EALDH1A1ACSS2 | |
| SCHEMBL17677350 | 0.71 | KMT2A (0.43) | SMOKDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL16230017 | 0.71 | LMNA (0.41) | SMOCNR1KDM4EALDH1A1MAPT |
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-2011024873-A1 | FUSED HETEROCYCLIC RING DERIVATIVE AND USE THEREOF | 武田薬品工業株式会社 (JP) | 2011-03-03 | — | — | WO | disclosed |