Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.41 |
| ▸ | AGXT | P21549 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.38 |
| ▸ | APP | P05067 | 3/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | LDHA | P00338 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8176150 | 0.77 | ESR2 (0.43) | SMN1; SMN2NPC1POLBRAB9AALDH1A1 | |
| SCHEMBL4258718 | 0.72 | CA1 (0.43) | IDO1AGXTCA1CA2CALM1 | |
| SCHEMBL8176151 | 0.71 | TDP1 (0.47) | IDO1AGXTCA1CA2CALM1 | |
| SCHEMBL26985881 | 0.71 | CYP2C9 (0.53) | IDO1AGXTCA1CA2CALM1 | |
| SCHEMBL4254991 | 0.70 | IDO1 (0.40) | IDO1AGXTCA1CA2CALM1 | |
| SCHEMBL13410636 | 0.69 | IDO1 (0.50) | IDO1AGXTCA1CA2CALM1 | |
| SCHEMBL12714251 | 0.69 | IDO1 (0.50) | IDO1AGXTCA1CA2CALM1 | |
| SCHEMBL26941596 | 0.69 | ALDH1A1 (0.55) | HTTSMN1; SMN2NPC1POLBRAB9A | |
| SCHEMBL7492817 | 0.69 | IDO1 (0.53) | IDO1AGXTCA1CA2CALM1 | |
| SCHEMBL2610461 | 0.68 | IDO1 (0.57) | IDO1AGXTCA1CA2CALM1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0705264-A1 | CARBO-ACYCLIC NUCLEOSIDE DERIVATIVES AS ANTIVIRAL AND ANTINEOPLASTIC AGENTS | MERRELL PHARMACEUTICALS INC. (US) | 1996-04-10 | — | — | EP | disclosed |