Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | JAK1 | P23458 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 8/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1688845 | 0.75 | C5AR1 (0.38) | ALDH1A1SMN1; SMN2KDM4ETDP1HPGD | |
| SCHEMBL4905776 | 0.75 | SMN1; SMN2 (0.53) | ALDH1A1SMN1; SMN2KDM4ETDP1HPGD | |
| SCHEMBL8525319 | 0.73 | PTPN1 (0.41) | ALDH1A1SMN1; SMN2KDM4ETDP1HPGD | |
| SCHEMBL12939226 | 0.70 | GAA (0.49) | ALDH1A1SMN1; SMN2KDM4ETDP1HPGD | |
| SCHEMBL7619750 | 0.70 | MEN1 (0.49) | ALDH1A1SMN1; SMN2KDM4ETDP1HPGD | |
| SCHEMBL8525317 | 0.69 | XDH (0.39) | ALDH1A1SMN1; SMN2KDM4ETDP1MAPT | |
| SCHEMBL20869224 | 0.68 | ALDH5A1 (0.53) | ALDH1A1SMN1; SMN2KDM4ETDP1HPGD | |
| SCHEMBL19632973 | 0.68 | ABCG2 (0.47) | ALDH1A1SMN1; SMN2KDM4ETDP1HPGD | |
| SCHEMBL544101 | 0.68 | C5AR1 (0.44) | ALDH1A1MEN1KMT2ACYP3A4LMNA | |
| SCHEMBL12647578 | 0.67 | CYP3A4 (0.49) | ALDH1A1SMN1; SMN2KDM4ETDP1HPGD |
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 |