Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | F7 | P08709 | 2/20 | 0.41 |
| ▸ | F3 | P13726 | 2/20 | 0.41 |
| ▸ | TTR | P02766 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | BCKDK | O14874 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Bromomethane SCHEMBL10465375 | 0.95 | MCL1 (0.49) | MCL1ALDH1A1KDM4ECYP2C9CYP1A2 | |
| SCHEMBL11455372 | 0.87 | MCL1 (0.41) | MCL1ALDH1A1CYP2C9HPGDPTGES | |
| SCHEMBL29156466 | 0.86 | MCL1 (0.49) | MCL1ALDH1A1KDM4ECYP2C9CYP1A2 | |
| SCHEMBL11684469 | 0.84 | MAOB (0.43) | MCL1ALDH1A1KDM4ECYP2C9CYP1A2 | |
| SCHEMBL6239414 | 0.80 | KDM4E (0.46) | ALDH1A1KDM4ECYP2C9CYP1A2GPR35 | |
| SCHEMBL7633234 | 0.79 | PIM1 (0.45) | MCL1ALDH1A1KDM4EGPR35L3MBTL1 | |
| SCHEMBL658543 | 0.77 | PDPK1 (0.40) | MCL1CYP2C9CYP1A2TTRMEN1 | |
| SCHEMBL658917 | 0.77 | PDPK1 (0.40) | MCL1CYP2C9CYP1A2TTRMEN1 | |
| SCHEMBL658542 | 0.77 | PDPK1 (0.40) | MCL1CYP2C9CYP1A2TTRMEN1 | |
| SCHEMBL9669854 | 0.77 | KDM1A (0.39) | MCL1KDM4ECYP2C9CYP1A2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1102535-A4 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORP (US) | 2004-09-29 | — | — | EP | disclosed |
| US-6399656-B1 | USING A BENZOPYRAN-3-CARBOXAMIDE COMPOUND | SMITHKLINE BEECHAM CORPORATION | 2002-06-04 | — | — | US | disclosed |
| EP-1102535-A2 | COMPOUNDS AND METHODS | SmithKline Beecham Corporation (US) | 2001-05-30 | — | — | EP | disclosed |
| WO-2000006085-A2 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 2000-02-10 | — | — | WO | disclosed |