Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.38 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.37 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CTSD | P07339 | 1/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27761127 | 0.87 | HPGD (0.46) | ALDH1A1LMNAKDM4EGLAHPGD | |
| SCHEMBL28164002 | 0.86 | ALDH1A1 (0.45) | ALDH1A1LMNAKDM4EHPGDTSHR | |
| SCHEMBL27799176 | 0.86 | ALDH1A1 (0.45) | ALDH1A1LMNAHPGDTSHRFOLH1 | |
| SCHEMBL5694901 | 0.85 | ALDH1A1 (0.42) | ALDH1A1LMNAHPGDTSHRCTSD | |
| SCHEMBL28139529 | 0.82 | ALDH1A1 (0.41) | ALDH1A1LMNAKDM4EHPGDTSHR | |
| SCHEMBL7684247 | 0.82 | ALDH1A1 (0.44) | ALDH1A1LMNAKDM4EHPGDTSHR | |
| SCHEMBL27587079 | 0.82 | ALDH1A1 (0.41) | ALDH1A1LMNAKDM4EHPGDTSHR | |
| SCHEMBL2655484 | 0.80 | ALDH1A1 (0.70) | ALDH1A1LMNAKDM4EGLATSHR | |
| SCHEMBL27761126 | 0.79 | ALDH1A1 (0.39) | ALDH1A1LMNAKDM4EHPGDTSHR | |
| SCHEMBL6237542 | 0.74 | TSHR (0.41) | ALDH1A1LMNAKDM4EHPGDTSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104151200-B | Hdac inhibitor | 葛兰素史克知识产权发展有限公司 | 2017-06-20 | — | — | CN | disclosed |
| CN-104151200-A | Hdac inhibitors | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENTLTD | 2014-11-19 | — | — | CN | disclosed |
| CN-101528677-B | Hdac inhibitors | GSK IP DEV CORP | 2014-07-30 | — | — | CN | disclosed |
| CN-101528677-A | HDAC inhibitors | CHROMA THERAPEUTICS LTD (GB) | 2009-09-09 | — | — | CN | disclosed |