Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 2/20 | 0.43 |
| ▸ | PTPRC | P08575 | 2/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | S100A4 | P26447 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.41 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.41 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.41 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | MYC | P01106 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11112459 | 0.87 | AKR1B1 (0.43) | AKR1B1PTPRCBCHEACHECES1 | |
| SCHEMBL11105120 | 0.80 | THRB (0.47) | MAPTALDH1A1 | |
| SCHEMBL11108879 | 0.80 | PDK2 (0.42) | AKR1B1MAPTALDH1A1 | |
| SCHEMBL11108165 | 0.80 | PDK2 (0.41) | AKR1B1S100A4MAPTALDH1A1MEN1 | |
| SCHEMBL11104504 | 0.80 | AKR1B1 (0.44) | AKR1B1PTPRCBCHEACHECES1 | |
| SCHEMBL11109755 | 0.80 | AKR1B1 (0.43) | AKR1B1PTPRCBCHEACHECES1 | |
| SCHEMBL11106102 | 0.78 | PDK2 (0.46) | MAPTALDH1A1MEN1KMT2ARECQL | |
| SCHEMBL11113054 | 0.77 | TP53 (0.40) | MAPTALDH1A1MEN1KMT2APTGDR2 | |
| SCHEMBL11105579 | 0.77 | PTPRC (0.41) | AKR1B1PTPRCBCHEACHECES1 | |
| SCHEMBL11108081 | 0.75 | MAPT (0.43) | AKR1B1MAPTALDH1A1MEN1KMT2A |
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-4463001-A | ANTIULCER AGENTS | FARMITALIA CARLO ERBA S.P.A. (IT) | 1984-07-31 | — | — | US | disclosed |