Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | HTR7 | P34969 | 2/20 | 0.42 |
| ▸ | HTR6 | P50406 | 2/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | IKBKB | O14920 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | COMT | P21964 | 2/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL9397232 | 0.96 | TSHR (0.53) | TSHRALOX15KDM4EHTR7HTR6 | |
| SCHEMBL9397162 | 0.85 | ALDH1A1 (0.56) | TSHRALOX15KDM4EKMT2AALDH1A1 | |
| SCHEMBL9344872 | 0.84 | TSHR (0.53) | TSHRALOX15KDM4EHTR7HTR6 | |
| SCHEMBL9397301 | 0.83 | TSHR (0.57) | TSHRALOX15KDM4EHTR7HTR6 | |
| SCHEMBL9398295 | 0.83 | TSHR (0.53) | TSHRALOX15KDM4EHTR7HTR6 | |
| SCHEMBL9345579 | 0.82 | TSHR (0.51) | TSHRALOX15KDM4EHTR7HTR6 | |
| SCHEMBL9349857 | 0.81 | TSHR (0.50) | TSHRALOX15KDM4EHTR7HTR6 | |
| SCHEMBL9398483 | 0.81 | KDM4E (0.50) | TSHRALOX15KDM4EHTR7HTR6 | |
| SCHEMBL9349900 | 0.81 | TSHR (0.50) | TSHRALOX15KDM4EHTR7HTR6 | |
| SCHEMBL9398241 | 0.80 | TSHR (0.59) | TSHRKDM4EKMT2AALDH1A1HPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5340811-A | Bronchodilator agent | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1994-08-23 | — | — | US | disclosed |
| EP-0471841-A1 | SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1992-02-26 | — | — | EP | disclosed |