Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.49 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | F10 | P00742 | 3/20 | 0.44 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.40 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.39 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CMA1 | P23946 | 1/20 | 0.39 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4692282 | 0.85 | ALDH1A1 (0.63) | ALDH1A1F10HPGDEIF2AK2POLB | |
| SCHEMBL14491992 | 0.81 | DDB1 (0.53) | ALDH1A1F10SMN1; SMN2NPC1POLB | |
| SCHEMBL4744986 | 0.80 | ALDH1A1 (0.48) | ALDH1A1F10HPGDSMN1; SMN2NPC1 | |
| Hydrochloric Acid SCHEMBL5314439 | 0.80 | DDB1 (0.51) | ALDH1A1F10SMN1; SMN2NPC1POLB | |
| SCHEMBL14686809 | 0.77 | HTT (0.52) | ALDH1A1HPGDSMN1; SMN2NPC1MAPT | |
| SCHEMBL25680366 | 0.77 | EIF2AK2 (0.46) | BCAT2ALDH1A1F10HPGDEIF2AK2 | |
| SCHEMBL4418893 | 0.77 | ALDH1A1 (0.75) | BCAT2ALDH1A1HPGDSMN1; SMN2NPC1 | |
| SCHEMBL6324186 | 0.76 | RXFP1 (0.40) | ALDH1A1F10HPGDSMN1; SMN2POLB | |
| SCHEMBL8286230 | 0.76 | SMN1; SMN2 (0.54) | ALDH1A1HPGDF2SMN1; SMN2NPC1 | |
| SCHEMBL1259982 | 0.76 | ALDH1A1 (0.46) | ALDH1A1HPGDNPC1POLBMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004082687-A1 | LACTAM-CONTAINING CYCLIC DIAMINES AND DERIVATIVES AS FACTOR XA INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-09-30 | — | — | WO | disclosed |