Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G2D | Q9UNK4 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.54 |
| ▸ | PLA2G4B | P0C869 | 2/20 | 0.54 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.51 |
| ▸ | RARB | P10826 | 3/20 | 0.51 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.50 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9513108 | 1.00 | PLA2G2D (0.57) | PLA2G2DALDH1A1HPGDTP53TSHR | |
| SCHEMBL9515443 | 1.00 | PLA2G2D (0.57) | PLA2G2DALDH1A1HPGDTP53TSHR | |
| SCHEMBL9513056 | 0.99 | PLA2G2D (0.58) | PLA2G2DALDH1A1HPGDTP53TSHR | |
| SCHEMBL9515491 | 0.99 | PLA2G2D (0.58) | PLA2G2DALDH1A1HPGDTP53TSHR | |
| SCHEMBL9514125 | 0.99 | PLA2G2D (0.58) | PLA2G2DALDH1A1HPGDTP53TSHR | |
| SCHEMBL9516481 | 0.87 | NPC1 (0.53) | ALDH1A1TSHR | |
| SCHEMBL9513101 | 0.87 | SMPD1 (0.47) | PLA2G2DALDH1A1HPGDTP53TSHR | |
| SCHEMBL9516441 | 0.87 | SMPD1 (0.47) | PLA2G2DALDH1A1HPGDTP53TSHR | |
| SCHEMBL9515434 | 0.87 | SMPD1 (0.47) | PLA2G2DALDH1A1HPGDTP53TSHR | |
| SCHEMBL9512865 | 0.87 | SMPD1 (0.52) | PLA2G2DSMPD1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0308977-B1 | Anthracycline derivatives having inhibitory activity against reverse transcriptase of human immunodeficiency virus | ZAIDAN HOJIN BISEIBUTSU (JP) | 1993-12-08 | — | — | EP | disclosed |
| US-5003055-A | Anthracycline derivatives having inhibitory activity against reverse transcriptase of human immunodeficiency virus | ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) | 1991-03-26 | — | — | US | disclosed |
| EP-0308977-A2 | Anthracycline derivatives having inhibitory activity against reverse transcriptase of human immunodeficiency virus | ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) | 1989-03-29 | — | — | EP | disclosed |