Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 2/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 5/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.36 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.35 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.35 |
| ▸ | TTR | P02766 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | DHFR | P00374 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | ALB | P02768 | 1/20 | 0.34 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3656313 | 0.83 | TTR (0.44) | AKR1C3AKR1C2TTRKDM4EMEN1 | |
| SCHEMBL3075835 | 0.77 | PTGS2 (0.46) | APPAKR1C3AKR1C2TTRCA1 | |
| SCHEMBL3069023 | 0.75 | APP (0.42) | APPAKR1C3AKR1C2NR3C2TTR | |
| SCHEMBL3659362 | 0.74 | NOTUM (0.42) | SLC7A5CA1CA2GABRA1GABRG2 | |
| SCHEMBL19155483 | 0.73 | ALPL (0.45) | AKR1C3TTRKDM4EMEN1LMNA | |
| SCHEMBL19139982 | 0.72 | NPC1 (0.44) | AKR1C3KDM4EMEN1LMNAKMT2A | |
| SCHEMBL9893460 | 0.69 | ACMSD (0.64) | APPAKR1C3AKR1C2TTRKDM4E | |
| SCHEMBL19320830 | 0.69 | PTGER1 (0.44) | AKR1C3AKR1C2TTRKDM4EMEN1 | |
| SCHEMBL21711625 | 0.68 | WDR5 (0.52) | WDR5 | |
| SCHEMBL19140032 | 0.68 | PSEN1 (0.41) | AKR1C3KDM4EMEN1LMNAKMT2A |
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-2215049-A1 | P2X3, RECEPTOR ANTAGONISTS FOR TREATMENT OF PAIN | Merck Sharp & Dohme Corp. (US) | 2010-08-11 | — | — | EP | disclosed |
| WO-2009058298-A1 | P2X3, RECEPTOR ANTAGONISTS FOR TREATMENT OF PAIN | MERCK & CO., INC. (US) | 2009-05-07 | — | — | WO | disclosed |