Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MC4R | P32245 | 2/20 | 0.52 |
| ▸ | BCHE | P06276 | 9/20 | 0.52 |
| ▸ | JAK3 | P52333 | 1/20 | 0.51 |
| ▸ | NMT1 | P30419 | 1/20 | 0.49 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL13177134 | 1.00 | MC4R (0.52) | MC4RBCHEJAK3NMT1CHRM3 | |
| SCHEMBL13739175 | 0.92 | BCHE (0.55) | MC4RBCHEJAK3NMT1CHRM3 | |
| SCHEMBL27557534 | 0.90 | MC4R (0.59) | MC4RBCHEUSP2ALDH1A1HPGD | |
| Trifluoroacetic Acid SCHEMBL7734262 | 0.84 | NMT1 (0.48) | MC4RBCHENMT1CHRM3KCNA3 | |
| SCHEMBL27810920 | 0.84 | BCHE (0.61) | MC4RBCHEUSP2ALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL25343495 | 0.83 | BCHE (0.53) | MC4RBCHEJAK3 | |
| SCHEMBL27652150 | 0.81 | HDAC3 (0.60) | BCHEUSP2ALDH1A1HPGDKCNA3 | |
| SCHEMBL27742584 | 0.81 | F2 (0.63) | BCHEUSP2ALDH1A1HPGDKCNA3 | |
| SCHEMBL27630590 | 0.80 | HDAC3 (0.62) | BCHEUSP2ALDH1A1HPGDKCNA3 | |
| SCHEMBL27709635 | 0.78 | BCHE (0.59) | BCHEUSP2ALDH1A1HPGDKCNA3 |
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-104781255-A | N-pyrrolidinyl, N' -pyrazolyl-urea, thiourea, guanidine and cyanoguanidine compounds as TRKA kinase inhibitors | ARRAY BIOPHARMA INC | 2015-07-15 | — | — | CN | disclosed |