Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.42 |
| ▸ | NAAA | Q02083 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | PPM1B | O75688 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7669796 | 1.00 | ALDH1A1 (0.52) | ALDH1A1ATMTSHRHPGDCHRM2 | |
| SCHEMBL1298046 | 0.93 | ALDH1A1 (0.54) | ALDH1A1ATMTSHRHPGDCHRM2 | |
| SCHEMBL16433766 | 0.92 | ALDH1A1 (0.45) | ALDH1A1ATMTSHRHPGDCHRM2 | |
| SCHEMBL2251674 | 0.92 | ALDH1A1 (0.48) | ALDH1A1ATMTSHRHPGDCHRM2 | |
| SCHEMBL813586 | 0.92 | ALDH1A1 (0.48) | ALDH1A1ATMTSHRHPGDCHRM2 | |
| SCHEMBL234282 | 0.92 | ALDH1A1 (0.48) | ALDH1A1ATMTSHRHPGDCHRM2 | |
| SCHEMBL2583177 | 0.92 | ALDH1A1 (0.48) | ALDH1A1ATMTSHRHPGDCHRM2 | |
| SCHEMBL812938 | 0.92 | ALDH1A1 (0.48) | ALDH1A1ATMTSHRHPGDCHRM2 | |
| SCHEMBL22872240 | 0.91 | ALDH1A1 (0.44) | ALDH1A1ATMTSHRHPGDCHRM2 | |
| SCHEMBL15760063 | 0.91 | ALDH1A1 (0.44) | ALDH1A1ATMTSHRHPGDCHRM2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6376539-B1 | ANTIISCHEMIC AGENTS, CENTRAL NERVOUS SYSTEM DISORDERS | BAYER AKTIENGESELLSCHAFT (DE) | 2002-04-23 | — | — | US | disclosed |