Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | BLM | P54132 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | MAP2 | P11137 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8925097 | 0.88 | KDM4E (0.53) | KDM4ECYP1A2POLBCYP3A4CYP2C9 | |
| SCHEMBL8924857 | 0.86 | ALDH1A1 (0.52) | KDM4ECYP1A2POLBCYP3A4CYP2C9 | |
| SCHEMBL8923512 | 0.86 | KDM4E (0.51) | KDM4ECYP1A2POLBCYP3A4CYP2C9 | |
| SCHEMBL8925015 | 0.81 | KDM4E (0.50) | KDM4ECYP1A2POLBCYP3A4CYP2C9 | |
| SCHEMBL8925077 | 0.80 | MAPT (0.51) | KDM4ECYP1A2POLBCYP3A4CYP2C9 | |
| SCHEMBL8924448 | 0.78 | KDM4E (0.59) | KDM4ECYP1A2POLBCYP3A4CYP2C9 | |
| SCHEMBL8923261 | 0.78 | KDM4E (0.50) | KDM4ECYP1A2POLBCYP3A4CYP2C9 | |
| SCHEMBL1612505 | 0.78 | KDM4E (0.79) | KDM4ECYP1A2POLBCYP3A4CYP2C9 | |
| SCHEMBL16814457 | 0.77 | MAP2 (0.54) | KDM4ECYP1A2POLBALDH1A1CA1 | |
| SCHEMBL8925682 | 0.77 | ADORA1 (0.47) | KDM4ECYP1A2POLBCYP3A4CYP2C9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1993011115-A2 | QUINOLONE DERIVATIVES AND THEIR USE AS NMDA AND AMPA RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 1993-06-10 | — | — | WO | claimed |
| US-5614532-A | NERVOUS SYSTEM DISORDERS USING N-METHYLASPARTATE ANTAGONIST | MERCK, SHARP & DOHME LTD. (GB) | 1997-03-25 | — | — | US | disclosed |
| EP-0620812-A1 | QUINOLONE DERIVATIVES | MERCK SHARP & DOHME LTD. (GB) | 1994-10-26 | — | — | EP | disclosed |
| WO-1993011115-A2 | QUINOLONE DERIVATIVES AND THEIR USE AS NMDA AND AMPA RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 1993-06-10 | — | — | WO | disclosed |