Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | NAMPT | P43490 | 3/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.47 |
| ▸ | SRD5A2 | P31213 | 4/20 | 0.47 |
| ▸ | MYC | P01106 | 1/20 | 0.45 |
| ▸ | SRD5A1 | P18405 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28052395 | 0.86 | MYC (0.56) | ALDH1A1HDAC6HDAC8MYCMEN1 | |
| SCHEMBL28205358 | 0.85 | NAMPT (0.49) | ALDH1A1NAMPTHDAC6HDAC8KDM4E | |
| SCHEMBL7277193 | 0.85 | NOTUM (0.58) | ALDH1A1NAMPTHDAC6HDAC8SRD5A2 | |
| SCHEMBL28956614 | 0.82 | HDAC6 (0.50) | NAMPTHDAC6HDAC8 | |
| SCHEMBL29168673 | 0.81 | HDAC6 (0.56) | ALDH1A1NAMPTHDAC6HDAC8 | |
| SCHEMBL1027717 | 0.81 | NAMPT (0.54) | ALDH1A1NAMPTHDAC6HDAC8KDM4E | |
| SCHEMBL19339147 | 0.81 | ALDH1A1 (0.53) | ALDH1A1NAMPTHDAC6HDAC8SRD5A2 | |
| SCHEMBL3313453 | 0.81 | ALDH1A1 (0.53) | ALDH1A1NAMPTHDAC6HDAC8SRD5A2 | |
| SCHEMBL566491 | 0.80 | HDAC6 (0.51) | NAMPTHDAC6HDAC8 | |
| SCHEMBL2814463 | 0.79 | KMT2A (0.57) | ALDH1A1MAPTPOLBMEN1MAPK1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023284651-A1 | N-(2-AMINOPHENYL)BENZAMIDE COMPOUND AND APPLICATION THEREOF | 南京明德新药研发有限公司 | 2023-01-19 | — | — | WO | disclosed |
| CN-1889970-B | Macrocyclic carboxylic acids and acylsulfonamides as inhibitors of HCV replication | INTERMUNE INC | 2012-06-13 | — | — | CN | disclosed |
| EP-2274283-A1 | NOVEL N-SUBSTITUTED TETRAHYDROISOQUINOLINE/ISOINDOLINE HYDROXAMIC ACID COMPOUNDS | 4SC AG (DE) | 2011-01-19 | — | — | EP | disclosed |
| WO-2009112550-A1 | NOVEL N-SUBSTITUTED TETRAHYDROISOQUINOLINE/ISOINDOLINE HYDROXAMIC ACID COMPOUNDS | 4SC AG (DE) | 2009-09-17 | — | — | WO | disclosed |
| CN-1889970-A | Macrocyclic carboxylic acids and acylsulfonamides as inhibitors of HCV replication | INTERMUNE INC (US) | 2007-01-03 | — | — | CN | disclosed |