Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 7/20 | 0.56 |
| ▸ | NPC1 | O15118 | 6/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | PLAU | P00749 | 2/20 | 0.55 |
| ▸ | F2 | P00734 | 1/20 | 0.52 |
| ▸ | PLG | P00747 | 1/20 | 0.52 |
| ▸ | PLAT | P00750 | 1/20 | 0.52 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.52 |
| ▸ | KLK1 | P06870 | 1/20 | 0.52 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.52 |
| ▸ | JAK2 | O60674 | 1/20 | 0.51 |
| ▸ | JAK1 | P23458 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL25402169 | 0.80 | HDAC6 (0.46) | HDAC2HDAC8HDAC6HDAC1 | |
| SCHEMBL25401469 | 0.78 | TDP1 (0.53) | RAB9ANPC1ALDH1A1POLBMAPT | |
| SCHEMBL27061741 | 0.77 | TP53 (0.47) | RAB9ANPC1ALDH1A1POLBMAPT | |
| SCHEMBL25753506 | 0.75 | MAPT (0.50) | RAB9ANPC1ALDH1A1POLBMAPT | |
| SCHEMBL27703253 | 0.75 | MEN1 (0.65) | RAB9ANPC1ALDH1A1POLBMAPT | |
| SCHEMBL2467402 | 0.75 | PLAU (0.78) | RAB9ANPC1POLBMAPTPLAU | |
| SCHEMBL21730148 | 0.74 | KDM4E (0.50) | ALDH1A1MAPTHPGDKDM4EMEN1 | |
| SCHEMBL9989116 | 0.74 | NPC1 (0.60) | RAB9ANPC1ALDH1A1KDM4EMAPK1 | |
| SCHEMBL14111908 | 0.73 | PLAU (0.76) | RAB9ANPC1PLAUF2PLG | |
| SCHEMBL31680516 | 0.73 | L3MBTL1 (0.48) | RAB9ANPC1ALDH1A1POLBHPGD |
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-3122344-A2 | TrkA KINASE INHIBITORS, COMPOSITIONS AND METHODS THEREOF | Merck Sharp & Dohme Corp. (US) | 2017-02-01 | — | — | EP | claimed |
| WO-2015148354-A2 | TrkA KINASE INHIBITORS, COMPOSITIONS AND METHODS THEREOF | MERCK SHARP & DOHME CORP. (US) | 2015-10-01 | — | — | WO | claimed |