Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | GRIN2B | Q13224 | 8/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | RIPK3 | Q9Y572 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3367040 | 0.91 | FKBP1A (0.53) | GRIN2BNPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL3366604 | 0.90 | POLB (0.45) | TSHRNPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL6497228 | 0.84 | ALDH1A1 (0.55) | GRIN2BNPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL6490734 | 0.82 | RAB9A (0.44) | TSHRNPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL1385459 | 0.82 | BACE1 (0.46) | KDM4E | |
| SCHEMBL1386652 | 0.82 | BACE1 (0.48) | — | |
| SCHEMBL6498110 | 0.81 | HRH3 (0.44) | NPC1RAB9AALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL1386524 | 0.75 | SCN4A (0.42) | ALDH1A1 | |
| SCHEMBL1384448 | 0.75 | SCN4A (0.44) | KDM4E | |
| SCHEMBL3365074 | 0.73 | SCN4A (0.43) | — |
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-1173169-B1 | ARYL SUBSTITUTED PYRAZOLES, IMIDAZOLES, OXAZOLES, THIAZOLES AND PYRROLES, AND THE USE THEREOF | EURO CELTIQUE SA (LU) | 2010-05-12 | — | — | EP | claimed |