Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | APAF1 | O14727 | 1/20 | 0.41 |
| ▸ | TDP2 | O95551 | 1/20 | 0.41 |
| ▸ | NSD2 | O96028 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.41 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.41 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.41 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27857181 | 0.89 | HDAC1 (0.49) | HDAC1KDM4EALDH1A1KMT2APOLB | |
| SCHEMBL27352942 | 0.78 | HDAC1 (0.47) | HDAC1KDM4EALDH1A1NPC1MEN1 | |
| SCHEMBL28711268 | 0.78 | KMT2A (0.42) | HDAC1ALDH1A1NPC1MEN1KMT2A | |
| SCHEMBL28711269 | 0.78 | KMT2A (0.42) | HDAC1ALDH1A1NPC1MEN1KMT2A | |
| SCHEMBL6672366 | 0.76 | MLYCD (0.54) | HDAC1ALDH1A1NPC1MEN1KMT2A | |
| SCHEMBL5533042 | 0.74 | ALDH1A1 (0.69) | HDAC1KDM4EALDH1A1NPC1MEN1 | |
| SCHEMBL3089099 | 0.73 | KMT2A (0.61) | KDM4ENPC1KMT2AEGFRERBB2 | |
| SCHEMBL11041431 | 0.72 | NPC1 (0.55) | ALDH1A1NPC1MEN1KMT2APOLB | |
| SCHEMBL17223137 | 0.71 | PLAU (0.49) | KDM4ENPC1MEN1KMT2APOLB | |
| SCHEMBL6508853 | 0.71 | ALDH1A1 (0.41) | KDM4EALDH1A1NPC1MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1064354-C | Antimicrobial 5- (N-heterosubstituted amino) quinolones and pharmaceutical compositions | AMERICAN CYANAMID CO (US) | 2001-04-11 | — | — | CN | disclosed |
| CN-1061658-C | Tricyclic benzazepine vasopressin antagonists | AMERICAN CYANAMID CO (US) | 2001-02-07 | — | — | CN | disclosed |
| CN-1106802-A | Tricyclic benzazepines (aza *) vasopressin antagonists | AMERICAN CYANAMID CO (US) | 1995-08-16 | — | — | CN | disclosed |