Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | YTHDC1 | Q96MU7 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.38 |
| ▸ | CDK2 | P24941 | 2/20 | 0.38 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 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 | |
|---|---|---|---|---|
| SCHEMBL3695026 | 1.00 | HDAC1 (0.43) | HDAC1HDAC6YTHDC1HPGDMAPK1 | |
| SCHEMBL3695020 | 1.00 | HDAC1 (0.43) | HDAC1HDAC6YTHDC1HPGDMAPK1 | |
| SCHEMBL3695025 | 1.00 | HDAC1 (0.43) | HDAC1HDAC6YTHDC1HPGDMAPK1 | |
| SCHEMBL3706237 | 0.91 | HDAC1 (0.47) | HDAC1HDAC6YTHDC1HPGDMAPK1 | |
| SCHEMBL3706244 | 0.91 | HDAC1 (0.47) | HDAC1HDAC6YTHDC1HPGDMAPK1 | |
| SCHEMBL3695038 | 0.90 | HDAC1 (0.47) | HDAC1HDAC6YTHDC1HPGDMAPK1 | |
| SCHEMBL3695037 | 0.90 | HDAC1 (0.47) | HDAC1HDAC6YTHDC1HPGDMAPK1 | |
| SCHEMBL3695022 | 0.88 | HDAC1 (0.46) | HDAC1HDAC6YTHDC1HPGDMAPK1 | |
| SCHEMBL3702155 | 0.88 | HDAC1 (0.46) | HDAC1HDAC6YTHDC1HPGDMAPK1 | |
| SCHEMBL3702160 | 0.88 | HDAC1 (0.46) | HDAC1HDAC6YTHDC1HPGDMAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2637669-A2 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | Infinity Pharmaceuticals, Inc. (US) | 2013-09-18 | — | — | EP | disclosed |
| WO-2012064973-A2 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | INFINITY PHARMACEUTICALS, INC. (US) | 2012-05-18 | — | — | WO | disclosed |