Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | ELANE | P08246 | 2/20 | 0.51 |
| ▸ | NQO2 | P16083 | 5/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.47 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | DCPS | Q96C86 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.41 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | G6PD | P11413 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13729067 | 0.88 | ALDH1A1 (0.57) | ALDH1A1KDM4EHPGDELANENQO2 | |
| SCHEMBL27030442 | 0.83 | ALDH1A1 (0.49) | ALDH1A1KDM4EHPGDELANENQO2 | |
| SCHEMBL31140889 | 0.79 | PARP1 (0.46) | ELANEPARP1PBRM1 | |
| SCHEMBL7811084 | 0.79 | PARP1 (0.46) | ELANEPARP1PBRM1 | |
| SCHEMBL11746030 | 0.76 | KDM4E (0.56) | ALDH1A1KDM4EHPGDELANENQO2 | |
| SCHEMBL7699141 | 0.76 | PDE3B (0.49) | ALDH1A1KDM4EHPGDNQO2HSP90AA1 | |
| SCHEMBL7814765 | 0.75 | KDM4E (0.59) | ALDH1A1KDM4EHPGDELANENQO2 | |
| SCHEMBL2539705 | 0.75 | HPGD (0.62) | ALDH1A1KDM4EHPGDNQO2MAPT | |
| SCHEMBL26606925 | 0.75 | NQO2 (0.37) | ALDH1A1KDM4EHPGDNQO2HSP90AA1 | |
| SCHEMBL30573125 | 0.74 | NQO2 (0.39) | ALDH1A1KDM4EHPGDNQO2HSP90AA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6320051-B1 | AMINO(NH) OR OXYGEN(O) SUBSTITUTED, ENZYME INHIBITORS OF STAPHLOCCOCUS AUREUS METHIONYL T-RNA SYNTHETASE (MRS); ANTIBACTERIAL AGENTS | SMITHKLINE BEECHAM PLC (GB) | 2001-11-20 | — | — | US | disclosed |
| CN-1307565-A | Quinolones used as MRS inhibitor and bactericides | SMITHKLINE BEECHAM PLC (GB) | 2001-08-08 | — | — | CN | disclosed |
| EP-1084110-A1 | QUINOLONES USED AS MRS INHIBITORS AND BACTERICIDES | SMITHKLINE BEECHAM PLC (GB) | 2001-03-21 | — | — | EP | disclosed |
| WO-1999055677-A1 | QUINOLONES USED AS MRS INHIBITORS AND BACTERICIDES | SMITHKLINE BEECHAM PLC (GB) | 1999-11-04 | — | — | WO | disclosed |