Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PHGDH | O43175 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 5/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | BRD2 | P25440 | 1/20 | 0.40 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.40 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.39 |
| ▸ | KHK | P50053 | 1/20 | 0.39 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | F10 | P00742 | 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 | |
|---|---|---|---|---|
| SCHEMBL882712 | 0.91 | HDAC6 (0.47) | PHGDHHDAC6BRD4BRD2BRD3 | |
| SCHEMBL874150 | 0.84 | HDAC6 (0.48) | PHGDHHDAC6BRD4BRD2BRD3 | |
| SCHEMBL874933 | 0.81 | PHGDH (0.52) | PHGDHHDAC6MAPTKMT2ALMNA | |
| SCHEMBL21961348 | 0.80 | BRD4 (0.46) | BRD4LMNABRD2BRD3BRDT | |
| SCHEMBL876507 | 0.80 | MAPT (0.46) | MAPTKMT2AALDH1A1HPGDHSP90AA1 | |
| SCHEMBL21961297 | 0.73 | BRD4 (0.50) | KMT2ABRD4LMNABRD2BRD3 | |
| SCHEMBL15723817 | 0.73 | BRD4 (0.50) | BRD4BRD2BRD3BRDTALDH1A1 | |
| SCHEMBL21960833 | 0.72 | BRD4 (0.49) | BRD4BRD2BRD3BRDT | |
| SCHEMBL882769 | 0.71 | HDAC6 (0.43) | PHGDHHDAC6MAPTKMT2ALMNA | |
| SCHEMBL876612 | 0.70 | CHRNA7 (0.46) | HDAC6KMT2ABRD4BRD2BRD3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012038905-A1 | THIENOPYRIDINE NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF | SANOFI (FR) | 2012-03-29 | — | — | WO | disclosed |
| WO-2012038904-A1 | NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF | SANOFI (FR) | 2012-03-29 | — | — | WO | disclosed |