Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 9/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 7/20 | 0.54 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 4/20 | 0.41 |
| ▸ | CA1 | P00915 | 4/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15269065 | 1.00 | PTGS2 (0.54) | PTGS2PTGS1HSD11B1KMT2AHPGD | |
| SCHEMBL17899439 | 0.91 | PTGS2 (0.46) | PTGS2PTGS1KMT2AHPGDKDM4E | |
| SCHEMBL17899437 | 0.91 | PTGS2 (0.46) | PTGS2PTGS1KMT2AHPGDKDM4E | |
| SCHEMBL15269021 | 0.91 | PTGS2 (0.46) | PTGS2PTGS1KMT2AHPGDKDM4E | |
| SCHEMBL15269073 | 0.91 | PTGS2 (0.46) | PTGS2PTGS1KMT2AHPGDKDM4E | |
| SCHEMBL17899425 | 0.90 | NPC1 (0.47) | PTGS2PTGS1KMT2AHPGDKDM4E | |
| SCHEMBL15269269 | 0.90 | HPGD (0.49) | PTGS2PTGS1KMT2AHPGDKDM4E | |
| SCHEMBL17899432 | 0.90 | HPGD (0.49) | PTGS2PTGS1KMT2AHPGDKDM4E | |
| SCHEMBL15269439 | 0.90 | NPC1 (0.47) | PTGS2PTGS1KMT2AHPGDKDM4E | |
| SCHEMBL15269327 | 0.89 | PTGS2 (0.55) | PTGS2PTGS1KMT2AHPGDKDM4E |
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-9388196-B2 | Thiazole derivatives as alpha 7 nAChR modulators | LUPIN LIMITED (IN) | 2016-07-12 | — | — | US | claimed |