Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 2/20 | 0.39 |
| ▸ | CCNB2 | O95067 | 3/20 | 0.36 |
| ▸ | CDK1 | P06493 | 3/20 | 0.36 |
| ▸ | CDK4 | P11802 | 3/20 | 0.36 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.36 |
| ▸ | CCND1 | P24385 | 3/20 | 0.36 |
| ▸ | CCNB3 | Q8WWL7 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9449080 | 0.74 | ALDH1A1 (0.46) | XDHCCNB2CDK1CDK4CCNB1 | |
| SCHEMBL1688845 | 0.74 | C5AR1 (0.38) | ALDH1A1KDM4ELMNASMN1; SMN2GAA | |
| SCHEMBL11195337 | 0.71 | XDH (0.53) | XDHCCNB2CDK1CDK4CCNB1 | |
| SCHEMBL14674909 | 0.71 | XDH (0.53) | XDHCCNB2CDK1CDK4CCNB1 | |
| SCHEMBL10583374 | 0.69 | CDK4 (0.44) | CCNB2CDK1CDK4CCNB1CCND1 | |
| SCHEMBL8525313 | 0.69 | ALDH1A1 (0.43) | ALDH1A1KDM4EMAPTLMNAMAPK1 | |
| SCHEMBL18255202 | 0.67 | XDH (0.48) | XDHCCNB2CDK1CDK4CCNB1 | |
| SCHEMBL14087957 | 0.67 | XDH (0.69) | XDHCCNB2CDK1CDK4CCNB1 | |
| SCHEMBL14145570 | 0.67 | MAOB (0.44) | ALDH1A1KDM4EMAPTTRPA1LMNA | |
| SCHEMBL544101 | 0.67 | C5AR1 (0.44) | ALDH1A1LMNAALOX5CRHR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5977075-A | N-aroylamino acid amides as endothelin inhibitors | NOVARTIS AG (CH) | 1999-11-02 | — | — | US | disclosed |
| EP-0821670-A1 | N-AROYLAMINO ACID AMIDES AS ENDOTHELIN INHIBITORS | Novartis AG (CH) | 1998-02-04 | — | — | EP | disclosed |
| WO-1996033170-A1 | N-AROYLAMINO ACID AMIDES AS ENDOTHELIN INHIBITORS | NOVARITS AG (CH) | 1996-10-24 | — | — | WO | disclosed |