Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 1/20 | 0.57 |
| ▸ | PLK1 | P53350 | 1/20 | 0.49 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.46 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.46 |
| ▸ | KARS1 | Q15046 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | ABL1 | P00519 | 2/20 | 0.43 |
| ▸ | BCR | P11274 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9792898 | 0.83 | KMO (0.59) | KMOALDH1A1LMNAIRAK4CTSS | |
| SCHEMBL1509690 | 0.80 | KMO (0.58) | KMOMEN1KMT2ARAB9AALDH1A1 | |
| SCHEMBL4708076 | 0.78 | HSP90AA1 (0.67) | KMOPLK1CAMK2DMEN1KMT2A | |
| SCHEMBL18535 | 0.78 | CTSS (0.63) | KMOIRAK4CTSSCTSK | |
| SCHEMBL627394 | 0.76 | KARS1 (0.56) | PLK1CAMK2DMEN1KMT2ANPC1 | |
| SCHEMBL1466904 | 0.76 | CAMK2D (0.58) | KMOPLK1CAMK2DMEN1KMT2A | |
| SCHEMBL12171957 | 0.74 | MEN1 (0.64) | PLK1CAMK2DMEN1KMT2ANPC1 | |
| Hydrochloric Acid SCHEMBL4630422 | 0.74 | KARS1 (0.55) | PLK1CAMK2DMEN1KMT2ANPC1 | |
| SCHEMBL28024474 | 0.73 | KMO (0.58) | KMONPC1RAB9ALMNAMAPT | |
| SCHEMBL23662309 | 0.72 | ADORA2A (0.57) | KMOPRKACA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106794161-A | TrkA kinase inhibitors, composition and its method | 默沙东公司 | 2017-05-31 | — | — | CN | disclosed |