Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.62 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.55 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.55 |
| ▸ | FEN1 | P39748 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | STS | P08842 | 1/20 | 0.49 |
| ▸ | TNKS | O95271 | 1/20 | 0.49 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.49 |
| ▸ | PARP14 | Q460N5 | 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 | |
|---|---|---|---|---|
| SCHEMBL8897485 | 0.88 | AKR1C3 (0.78) | AKR1C3HDAC8ERCC5FEN1NPC1 | |
| SCHEMBL30057548 | 0.86 | AKR1C3 (0.75) | AKR1C3HDAC8ERCC5FEN1ALDH1A1 | |
| SCHEMBL11002454 | 0.86 | AKR1C3 (0.75) | AKR1C3HDAC8ERCC5FEN1ALDH1A1 | |
| SCHEMBL2868057 | 0.83 | SRD5A2 (0.70) | AKR1C3HDAC8ERCC5FEN1NPC1 | |
| SCHEMBL30643036 | 0.83 | SRD5A2 (0.70) | AKR1C3HDAC8ERCC5FEN1NPC1 | |
| SCHEMBL26624059 | 0.83 | SRD5A2 (0.70) | AKR1C3HDAC8ERCC5FEN1NPC1 | |
| SCHEMBL9938318 | 0.81 | MEN1 (0.70) | AKR1C3HDAC8ERCC5FEN1LMNA | |
| SCHEMBL14288321 | 0.81 | AKR1C3 (0.62) | AKR1C3HDAC8ERCC5FEN1LMNA | |
| Benzophenone SCHEMBL1147390 | 0.80 | ALDH1A1 (0.64) | LMNASMN1; SMN2ALDH1A1NPC1RAB9A | |
| Benzophenone SCHEMBL1147611 | 0.80 | ALDH1A1 (0.64) | LMNASMN1; SMN2ALDH1A1NPC1RAB9A |
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-4142054-A | TRIVALENT THALLIUM SALT | THE UPJOHN COMPANY (US) | 1979-02-27 | — | — | US | disclosed |