Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.41 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.41 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 3/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA9 | Q16790 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.39 |
| ▸ | GAA | P10253 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL4768985 | 0.85 | CA12 (0.46) | TSHRBAZ2BBAZ2ACA12CA1 | |
| SCHEMBL4773676 | 0.78 | TSHR (0.50) | TSHRBAZ2BBAZ2ACA12CA1 | |
| SCHEMBL31116594 | 0.77 | TSHR (0.49) | TSHRBAZ2BBAZ2ACA12CA1 | |
| SCHEMBL10314669 | 0.76 | TSHR (0.53) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL4763560 | 0.74 | CRHBP (0.38) | TSHRBAZ2BBAZ2ACA12CA1 | |
| SCHEMBL27739321 | 0.73 | ALDH1A1 (0.50) | TSHRALDH1A1KDM4EGAAMAPT | |
| SCHEMBL4763568 | 0.72 | CRHBP (0.36) | TSHRBAZ2BBAZ2ACA12CA1 | |
| SCHEMBL21979601 | 0.72 | BAZ2B (0.39) | TSHRTBXAS1BAZ2BBAZ2ACA12 | |
| SCHEMBL29209447 | 0.69 | TSHR (0.41) | TSHRBAZ2BBAZ2ACA12CA1 | |
| SCHEMBL1126850 | 0.69 | SLC18A3 (0.45) | ALDH1A1KDM4EHPGDMAPTNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1309565-B1 | HETEROCYCLIC MUTILIN ESTERS AND THEIR USE AS ANTIBACTERIALS | SMITHKLINE BEECHAM PLC (GB) | 2008-04-09 | — | — | EP | disclosed |