Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 8/20 | 0.49 |
| ▸ | AKR1C2 | P52895 | 8/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.46 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.46 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL27467818 | 0.87 | KDM4E (0.47) | AKR1C3AKR1C2MEN1KMT2APKM | |
| SCHEMBL28066427 | 0.81 | KMT2A (0.49) | AKR1C3AKR1C2MEN1KMT2APKM | |
| SCHEMBL28833380 | 0.81 | AKR1C3 (0.47) | AKR1C3AKR1C2MEN1KMT2APKM | |
| SCHEMBL5265644 | 0.81 | MKNK1 (0.51) | AKR1C3AKR1C2MEN1KMT2APKM | |
| SCHEMBL4934131 | 0.80 | PTPN1 (0.49) | AKR1C3AKR1C2MEN1KMT2APKM | |
| SCHEMBL294128 | 0.78 | AKR1C3 (0.78) | AKR1C3AKR1C2 | |
| SCHEMBL2835948 | 0.78 | PARP1 (0.55) | MAPK10KDM4ENPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1807116 | 0.77 | PARP1 (0.53) | MAPK10KDM4ENPC1RAB9ASMN1; SMN2 | |
| SCHEMBL22173608 | 0.77 | AKR1C3 (0.42) | AKR1C3AKR1C2MEN1KMT2ANPC1 | |
| SCHEMBL1034025 | 0.75 | ALDH1A1 (0.68) | KMT2ANPC1RAB9ATP53SMN1; SMN2 |
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-1169986-A | 2.9-diamino-and 2-amino-8-carbamoyl-4-hydroxy-aldanoic acid amide derivatives | CIBA GEIGY AG (CH) | 1998-01-14 | — | — | CN | disclosed |