Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.47 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.47 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.39 |
| ▸ | KMO | O15229 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | TTR | P02766 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1018609 | 0.83 | GRM1 (0.43) | TSHRKDM4EKMT2ASMN1; SMN2APEX1 | |
| SCHEMBL1015646 | 0.81 | AR (0.47) | TSHRARMRGPRX4SRD5A2KDM4E | |
| SCHEMBL4979269 | 0.75 | KMT2A (0.50) | TSHRARMRGPRX4KDM4EKMT2A | |
| SCHEMBL21899848 | 0.75 | TSHR (0.63) | TSHRARMRGPRX4SRD5A2KDM4E | |
| SCHEMBL13452529 | 0.74 | MRGPRX4 (0.70) | TSHRARMRGPRX4KDM4EKMT2A | |
| SCHEMBL31632675 | 0.74 | HTT (0.49) | TSHRSRD5A2KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL23777759 | 0.72 | ALDH1A1 (0.46) | TSHRARMRGPRX4KDM4EAPEX1 | |
| SCHEMBL30208087 | 0.72 | ALDH1A1 (0.46) | TSHRARMRGPRX4KDM4EAPEX1 | |
| Propylene Glycol SCHEMBL11018118 | 0.72 | HSP90AA1 (0.50) | TSHRSRD5A2KDM4EACE2MAPT | |
| SCHEMBL1254273 | 0.72 | TSHR (0.34) | TSHRARKDM4EKMT2ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2271642-A2 | PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING | Genentech, Inc. (US) | 2011-01-12 | — | — | EP | disclosed |
| WO-2009126863-A2 | PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING | GENENTECH, INC. (US) | 2009-10-15 | — | — | WO | disclosed |
| EP-1789390-A2 | PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING | Genentech, Inc. (US) | 2007-05-30 | — | — | EP | disclosed |
| WO-2006028958-A2 | PYRIDYL INHIBITORS OF HEDGEHOG SIGNALLING | GENENTECH, INC. (US) | 2006-03-16 | — | — | WO | disclosed |