Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.57 |
| ▸ | MEN1 | O00255 | 4/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.57 |
| ▸ | CRHBP | P24387 | 1/20 | 0.57 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.47 |
| ▸ | EGFR | P00533 | 1/20 | 0.47 |
| ▸ | RAF1 | P04049 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.47 |
| ▸ | CASP3 | P42574 | 3/20 | 0.44 |
| ▸ | NSD2 | O96028 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28342506 | 0.81 | ALDH1A1 (0.50) | KMT2AMEN1MAPK1TDP1CRHBP | |
| SCHEMBL28255690 | 0.77 | ALDH1A1 (0.55) | MAPK1TDP1ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL28342508 | 0.74 | APAF1 (0.44) | KMT2AMEN1MAPK1ALDH1A1MAPT | |
| SCHEMBL28592923 | 0.72 | CASP3 (0.42) | KMT2AMEN1MAPK1TDP1CRHBP | |
| SCHEMBL28339971 | 0.72 | MAPT (0.54) | KMT2AMEN1MAPK1TDP1ALDH1A1 | |
| SCHEMBL28340052 | 0.72 | MAPT (0.50) | KMT2AMEN1MAPK1TDP1ALDH1A1 | |
| SCHEMBL29724215 | 0.70 | CASP3 (0.72) | ALDH1A1MAPTCASP3LMNAPKM | |
| SCHEMBL950088 | 0.70 | CASP3 (0.72) | ALDH1A1MAPTCASP3LMNAPKM | |
| SCHEMBL28342527 | 0.70 | CASP3 (0.37) | KMT2AMEN1MAPK1TDP1CRHBP | |
| SCHEMBL24891254 | 0.69 | MEN1 (0.38) | KMT2AMEN1MAPK1TDP1CRHBP |
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 |
|---|---|---|---|---|---|---|---|
| CN-108912127-B | Benzo [ b, e ] azepine compound based on isatin skeleton and preparation method thereof | 青岛农业大学 | 2019-12-10 | — | — | CN | disclosed |