Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 1/20 | 0.61 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | DVL1 | O14640 | 1/20 | 0.34 |
| ▸ | DVL3 | Q92997 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1060990 | 0.86 | SMO (0.81) | SMOSMN1; SMN2KDM4EALDH1A1LMNA | |
| SCHEMBL13708904 | 0.82 | SMO (0.64) | SMOKDM4EALDH1A1LMNA | |
| SCHEMBL1063456 | 0.80 | SMO (0.82) | SMOCNR1SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL10292536 | 0.78 | SMO (0.46) | SMOCNR1SMN1; SMN2LMNAHTT | |
| SCHEMBL10004628 | 0.77 | SMO (0.59) | SMOSMN1; SMN2KDM4EALDH1A1LMNA | |
| Tak-441 SCHEMBL1061476 | 0.76 | SMO (1.00) | SMOKDM4EALDH1A1HSD17B10TP53 | |
| SCHEMBL12824871 | 0.75 | SMO (0.52) | SMOCNR1SMN1; SMN2LMNAHTT | |
| SCHEMBL1061383 | 0.75 | SMO (0.74) | SMOSMN1; SMN2LMNADRD4 | |
| SCHEMBL12825355 | 0.74 | SMO (0.47) | SMOCNR1TP53 | |
| SCHEMBL10005174 | 0.74 | SMO (0.78) | SMOKDM4EALDH1A1HSD17B10TP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2247588-B1 | FUSED HETEROCYCLIC DERIVATIVE AND USE THEREOF | TAKEDA PHARMACEUTICAL (JP) | 2016-04-13 | — | — | EP | disclosed |