Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | HPGD | P15428 | 4/20 | 0.59 |
| ▸ | POLB | P06746 | 3/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.59 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.59 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.59 |
| ▸ | CLK2 | P49760 | 1/20 | 0.59 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6530268 | 0.95 | KCNH2 (0.59) | KCNH2KDM4EALDH1A1HPGDPOLB | |
| SCHEMBL6529826 | 0.92 | KCNH2 (0.64) | KCNH2KDM4EALDH1A1HPGDPOLB | |
| SCHEMBL6528606 | 0.87 | KCNH2 (0.60) | KCNH2KDM4EALDH1A1HPGDPOLB | |
| SCHEMBL6502365 | 0.86 | KCNH2 (0.64) | KCNH2KDM4EALDH1A1HPGDPOLB | |
| SCHEMBL6528792 | 0.86 | KCNH2 (0.61) | KCNH2KDM4EALDH1A1HPGDPOLB | |
| SCHEMBL6509139 | 0.86 | KCNH2 (0.67) | KCNH2KDM4EALDH1A1HPGDPOLB | |
| SCHEMBL1155437 | 0.83 | KDM4E (0.65) | KCNH2KDM4EALDH1A1HPGDPOLB | |
| SCHEMBL6527488 | 0.83 | KCNH2 (0.72) | KCNH2KDM4EALDH1A1HPGDPOLB | |
| SCHEMBL6474352 | 0.83 | KCNH2 (0.72) | KCNH2KDM4EALDH1A1HPGDPOLB | |
| SCHEMBL6508139 | 0.82 | KCNH2 (0.60) | KCNH2KDM4EALDH1A1HPGDPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005051381-A1 | Substituted urea-octatydroindols as antagonists of melanin concentrating hormone receptor 1 (MCH1R) | BIOVITRUM AB (SE) | 2005-06-09 | — | — | WO | disclosed |
| WO-2005049602-A1 | QUINOLONE ANTIBACTERIAL AGENTS | WARNER-LAMBERT COMPANY LLC (US) | 2005-06-02 | — | — | WO | disclosed |
| WO-2005023189-A2 | METHOD OF COX-2 SELECTIVE INHIBITOR AND NITRIC OXIDE-DONATING AGENT | PHARMACIA CORPORATION (US) | 2005-03-17 | — | — | WO | disclosed |