Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 2/20 | 0.40 |
| ▸ | NQO2 | P16083 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.34 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.33 |
| ▸ | TUBB | P07437 | 1/20 | 0.33 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.33 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.33 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL355655 | 0.81 | PARP1 (0.40) | PARP1ALDH1A1KDM4EHPGDPDE4A | |
| SCHEMBL10723706 | 0.77 | ALDH1A1 (0.46) | PARP1ALDH1A1KDM4EHPGDPDE4A | |
| SCHEMBL27371146 | 0.73 | KDM4E (0.50) | PARP1ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL11006912 | 0.72 | PARP1 (0.43) | PARP1ALDH1A1KDM4EHPGDPDE4A | |
| SCHEMBL7655996 | 0.70 | KDM4E (0.40) | ALDH1A1KDM4EHPGDPDE4AMTNR1A | |
| SCHEMBL12379988 | 0.70 | ABCB1 (0.45) | PARP1ALDH1A1KDM4EHPGDPDE4A | |
| SCHEMBL28054318 | 0.69 | ADRA1A (0.38) | ALDH1A1KDM4EHPGDMTNR1AMTNR1B | |
| SCHEMBL11083684 | 0.68 | PARP1 (0.41) | PARP1ALDH1A1KDM4EHPGDPDE4A | |
| SCHEMBL11027320 | 0.65 | PARP1 (0.41) | PARP1ALDH1A1KDM4EHPGDPDE4A | |
| SCHEMBL2468652 | 0.64 | KDM4E (0.44) | ALDH1A1KDM4EMAPTTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5877218-A | PARKINSON'S DISEASE; ANTIEPILEPSY AGENTS; ANTICONVULSANTS | TEVA PHARMACEUTICAL INDUSTRIES, LTD. (IL) | 1999-03-02 | — | — | US | claimed |
| WO-1999033858-A9 | ESTRONE SULFAMATE INHIBITORS OF ESTRONE SULFATASE, AND ASSOCIATED PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE | STANFORD RES INST INT (US) | 1999-10-28 | — | — | WO | disclosed |