Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.40 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10649242 | 0.83 | TSHR (0.40) | TSHRKDM4ECYP3A4POLBCYP2C9 | |
| SCHEMBL10650460 | 0.83 | CYP11B1 (0.46) | TSHRKDM4ECYP3A4POLBCYP2C9 | |
| Hydrochloric Acid SCHEMBL10648079 | 0.82 | TSHR (0.39) | TSHRKDM4ECYP3A4POLBCYP2C9 | |
| Hydrochloric Acid SCHEMBL10648181 | 0.82 | CYP11B1 (0.46) | TSHRKDM4ECYP3A4POLBCYP2C9 | |
| SCHEMBL10648854 | 0.81 | CYP11B1 (0.47) | KDM4ECYP3A4MAPTALOX15MEN1 | |
| SCHEMBL10648690 | 0.81 | CYP11B1 (0.46) | KDM4ECYP3A4POLBHSD17B10TBK1 | |
| Hydrochloric Acid SCHEMBL10646340 | 0.81 | CYP11B1 (0.46) | KDM4ECYP3A4MAPTALOX15MEN1 | |
| Hydrochloric Acid SCHEMBL10651008 | 0.80 | CYP11B1 (0.46) | KDM4ECYP3A4POLBHSD17B10TBK1 | |
| SCHEMBL10646403 | 0.75 | CYP3A4 (0.43) | TSHRKDM4ECYP3A4POLBCYP2C9 | |
| SCHEMBL10650408 | 0.75 | CYP11B1 (0.45) | KDM4ECYP3A4POLBHSD17B10MAPT |
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-0128502-A1 | Substituted 6-(thien-2-yl)-3(2H)-pyridazinones and processes for their preparation | A. Nattermann & Cie. GmbH (DE) | 1984-12-19 | — | — | EP | disclosed |