Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 4/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 2/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | STAT3 | P40763 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | FLT1 | P17948 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18166296 | 0.91 | EPHX1 (0.45) | FAAHEPHX1KDM1AHDAC1SMN1; SMN2 | |
| SCHEMBL10244871 | 0.87 | HDAC1 (0.51) | KDM1AHDAC1SMN1; SMN2LMNARECQL | |
| SCHEMBL18166367 | 0.87 | MAOB (0.40) | FAAHSMN1; SMN2 | |
| SCHEMBL18166394 | 0.86 | ROCK1 (0.38) | LMNACDK2GSK3BCYP3A4 | |
| SCHEMBL18166274 | 0.85 | P2RX3 (0.49) | FAAH | |
| SCHEMBL18036393 | 0.83 | P2RX3 (0.43) | FAAH | |
| SCHEMBL18036425 | 0.82 | P2RX3 (0.35) | FAAHPTGS2 | |
| SCHEMBL18036367 | 0.82 | P2RX3 (0.35) | FAAHPTGS2 | |
| SCHEMBL18166460 | 0.81 | AKR1C3 (0.38) | SMN1; SMN2CDK2GSK3BCYP3A4POLB | |
| SCHEMBL18166380 | 0.80 | P2RX3 (0.48) | — |
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-2038264-B1 | TETRAZOLE-SUBSTITUTED ARYLAMIDES | HOFFMANN LA ROCHE (CH) | 2016-10-26 | — | — | EP | claimed |