Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | ANPEP | P15144 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | CASP6 | P55212 | 1/20 | 0.35 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 5/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8530425 | 0.87 | MTNR1A (0.41) | NPC1ALDH1A1KMT2AMAPK1L3MBTL1 | |
| SCHEMBL7449784 | 0.82 | PRNP (0.54) | CYP2C9KDM4ENPC1GAAALDH1A1 | |
| SCHEMBL7050182 | 0.81 | MAPK1 (0.37) | KDM4ENPC1ALDH1A1KMT2AMAPK1 | |
| SCHEMBL8528289 | 0.81 | CDC25B (0.39) | KDM4EALDH1A1CASP1CASP3CASP7 | |
| SCHEMBL27041447 | 0.78 | CYP3A4 (0.52) | CYP3A4CYP2C9CYP2C19ANPEPEPHX1 | |
| SCHEMBL7049697 | 0.78 | L3MBTL1 (0.35) | CYP2C9KDM4EGAAALDH1A1KMT2A | |
| SCHEMBL7050114 | 0.73 | CAPN1 (0.38) | CYP3A4CYP2C9CYP2C19CAPN1CTSB | |
| SCHEMBL7905195 | 0.71 | EPHX1 (0.65) | EPHX1KDM4EGAAALDH1A1KMT2A | |
| SCHEMBL9067733 | 0.71 | CAPN1 (0.44) | CYP3A4CYP2C9CYP2C19CAPN1CTSB | |
| SCHEMBL9067046 | 0.70 | SMN1; SMN2 (0.41) | ALDH1A1KMT2AMAPTHPGDSMN1; SMN2 |
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-5773428-A | BONE DISORDERS | SYNTEX (U.S.A.) INC. (US) | 1998-06-30 | — | — | US | disclosed |
| EP-0726903-A1 | MATRIX METALLOPROTEASE INHIBITORS | SYNTEX INC (US) | 1996-08-21 | — | — | EP | disclosed |
| WO-1995012603-A1 | MATRIX METALLOPROTEASE INHIBITORS________________________________ | SYNTEX (U.S.A.) INC. (US) | 1995-05-11 | — | — | WO | disclosed |