Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD1 | P17405 | 6/20 | 0.52 |
| ▸ | MGLL | Q99685 | 3/20 | 0.49 |
| ▸ | PLA2G2D | Q9UNK4 | 1/20 | 0.46 |
| ▸ | CNR2 | P34972 | 4/20 | 0.46 |
| ▸ | CNR1 | P21554 | 3/20 | 0.46 |
| ▸ | THRA | P10827 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9516481 | 0.90 | NPC1 (0.53) | — | |
| SCHEMBL9513056 | 0.88 | PLA2G2D (0.58) | PLA2G2D | |
| SCHEMBL9514125 | 0.88 | PLA2G2D (0.58) | PLA2G2D | |
| SCHEMBL9515491 | 0.88 | PLA2G2D (0.58) | PLA2G2D | |
| SCHEMBL9515443 | 0.87 | PLA2G2D (0.57) | SMPD1PLA2G2D | |
| SCHEMBL9516447 | 0.87 | PLA2G2D (0.57) | SMPD1PLA2G2D | |
| SCHEMBL9513108 | 0.87 | PLA2G2D (0.57) | SMPD1PLA2G2D | |
| SCHEMBL9514148 | 0.87 | SMPD1 (0.54) | SMPD1MGLLPLA2G2DCNR2CNR1 | |
| SCHEMBL9516441 | 0.85 | SMPD1 (0.47) | SMPD1PLA2G2DCNR2CNR1THRA | |
| SCHEMBL9513101 | 0.85 | SMPD1 (0.47) | SMPD1PLA2G2DCNR2CNR1THRA |
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 |