Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.62 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.51 |
| ▸ | FEN1 | P39748 | 1/20 | 0.51 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | KMO | O15229 | 1/20 | 0.49 |
| ▸ | TNKS | O95271 | 1/20 | 0.49 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.49 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.49 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.49 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.49 |
| ▸ | PARP2 | Q9UGN5 | 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 | |
|---|---|---|---|---|
| SCHEMBL13689271 | 0.87 | AKR1C3 (0.66) | AKR1C3HDAC8PTGS1ALDH1A1LMNA | |
| SCHEMBL11691009 | 0.85 | PARP10 (0.55) | PTGS1ALDH1A1SMN1; SMN2ERCC5FEN1 | |
| SCHEMBL11128506 | 0.84 | NPC1 (0.48) | AKR1C3NPC1MEN1CYP2D6KMT2A | |
| SCHEMBL10731484 | 0.84 | AKR1C3 (0.62) | AKR1C3HDAC8PTGS1ALDH1A1LMNA | |
| SCHEMBL10825923 | 0.81 | AKR1C3 (0.68) | AKR1C3HDAC8PTGS1ALDH1A1LMNA | |
| SCHEMBL27647734 | 0.81 | LMNA (0.53) | ALDH1A1LMNASMN1; SMN2NPC1MEN1 | |
| SCHEMBL27491000 | 0.80 | HSD17B1 (0.56) | PTGS1ALDH1A1LMNATNKSPARP15 | |
| SCHEMBL8767835 | 0.79 | AKR1C3 (0.64) | AKR1C3HDAC8PTGS1ALDH1A1LMNA | |
| SCHEMBL10716596 | 0.78 | ATM (0.55) | ALDH1A1LMNASMN1; SMN2NPC1MEN1 | |
| SCHEMBL2329814 | 0.78 | ATM (0.55) | ALDH1A1LMNASMN1; SMN2NPC1MEN1 |
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-4623736-A | INTERMEDIATES FOR ANALGESICS | THE UPJOHN COMPANY (US) | 1986-11-18 | — | — | US | disclosed |