Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | GAA | P10253 | 3/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | CRHBP | P24387 | 1/20 | 0.47 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL18707907 | 0.85 | CYP19A1 (0.54) | KDM4ECYP19A1MAPTGAATDP1 | |
| SCHEMBL9607477 | 0.84 | GAA (0.54) | KDM4ECYP19A1MAPTGAATDP1 | |
| SCHEMBL8512504 | 0.84 | GAA (0.54) | KDM4ECYP19A1MAPTGAATDP1 | |
| SCHEMBL21757316 | 0.84 | CYP19A1 (0.53) | KDM4ECYP19A1MAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL13381411 | 0.78 | ALDH1A1 (0.56) | KDM4ECYP19A1MAPTGAATDP1 | |
| SCHEMBL2488639 | 0.78 | MAPT (0.70) | KDM4ECYP19A1MAPTGAATDP1 | |
| SCHEMBL11801755 | 0.78 | MAPT (0.49) | KDM4ECYP19A1MAPTGAATDP1 | |
| SCHEMBL7488992 | 0.78 | MAPT (0.49) | KDM4ECYP19A1MAPTGAATDP1 | |
| Hydrochloric Acid SCHEMBL7020139 | 0.77 | MAPT (0.68) | KDM4ECYP19A1MAPTGAATDP1 | |
| SCHEMBL16142592 | 0.77 | CYP1A2 (0.56) | KDM4ECYP19A1MAPTGAATDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3252050-B1 | PHTHALAZINONES AND ISOQUINOLINONES AS ROCK INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2020-02-26 | — | — | EP | disclosed |
| EP-2945943-B1 | PHTHALAZINONES AND ISOQUINOLINONES AS ROCK INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2018-05-30 | — | — | EP | disclosed |