Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.36 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | METAP2 | P50579 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.30 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.30 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7109139 | 0.87 | SIRT1 (0.39) | ERN1ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL29421066 | 0.87 | SIRT1 (0.39) | ERN1ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL27800518 | 0.79 | SIRT1 (0.47) | ALDH1A1KDM4EMAPTHPGDTSHR | |
| SCHEMBL15380278 | 0.76 | DGAT1 (0.41) | HPGDSIRT1BCAT2DGAT1PARP1 | |
| SCHEMBL4581152 | 0.76 | SIRT1 (0.33) | ALDH1A1KDM4EMAPTHPGDTSHR | |
| SCHEMBL30211643 | 0.75 | ERN1 (0.54) | ERN1ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL3424158 | 0.75 | ERN1 (0.54) | ERN1ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL5316536 | 0.73 | BCAT2 (0.41) | ERN1ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL2294517 | 0.73 | SIRT1 (0.43) | ALDH1A1KDM4EMAPTHPGDTSHR | |
| SCHEMBL29948180 | 0.73 | SIRT1 (0.43) | ALDH1A1KDM4EMAPTHPGDTSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5049280-A | 2,3-dihydroxyterephthalamides as highly effective metal ion sequestering compounds | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1991-09-17 | — | — | US | disclosed |