Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 6/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | CETP | P11597 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10696390 | 0.94 | HSD17B10 (0.41) | CYP19A1HSD17B10KDM4ECYP2C9CYP1A2 | |
| SCHEMBL29222876 | 0.79 | SMN1; SMN2 (0.46) | KDM4EGAACYP2C9CYP1A2LMNA | |
| SCHEMBL28417292 | 0.78 | TDP1 (0.38) | CYP19A1KDM4EGAACYP2C9CYP1A2 | |
| SCHEMBL29222882 | 0.78 | KMT2A (0.48) | KDM4EGAACYP2C9CYP1A2LMNA | |
| SCHEMBL28812685 | 0.77 | L3MBTL1 (0.43) | KDM4EGAACYP3A4CYP2D6SMN1; SMN2 | |
| SCHEMBL14235051 | 0.74 | KDM4E (0.49) | KDM4EGAASMN1; SMN2KMT2ANPSR1 | |
| SCHEMBL23540070 | 0.72 | CA12 (0.35) | CYP19A1KDM4ENPC1KMT2AMAPK1 | |
| SCHEMBL16879859 | 0.71 | MMP2 (0.43) | GAALMNASMN1; SMN2KMT2ANPSR1 | |
| SCHEMBL2968414 | 0.71 | CA1 (0.42) | KDM4EGAALMNAKMT2AALDH1A1 | |
| SCHEMBL15626615 | 0.70 | KDM4E (0.51) | KDM4EGAALMNAKMT2ANPSR1 |
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-0253681-A2 | Cycloalkyl-substituted 4-pyridyl derivatives and process for their preparation | FARMITALIA CARLO ERBA S.r.l. (IT) | 1988-01-20 | — | — | EP | disclosed |