Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 2/20 | 0.52 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | PGR | P06401 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.43 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.43 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27616536 | 0.87 | NR1H2 (0.44) | NR1H2NR1H3KMT2AALDH1A1GLA | |
| SCHEMBL27556937 | 0.85 | KMT2A (0.45) | NR1H2NR1H3KMT2AALDH1A1CHRNB2 | |
| SCHEMBL11655001 | 0.84 | TDP1 (0.45) | NR1H2NR1H3KMT2AALDH1A1GLA | |
| SCHEMBL28218016 | 0.83 | ALDH1A1 (0.49) | NR1H2NR1H3KMT2AALDH1A1GLA | |
| SCHEMBL3343176 | 0.82 | ALDH1A1 (0.50) | NR1H2NR1H3KMT2AALDH1A1GLA | |
| SCHEMBL3343171 | 0.82 | ALDH1A1 (0.50) | NR1H2NR1H3KMT2AALDH1A1GLA | |
| Hydrochloric Acid SCHEMBL8940097 | 0.81 | ALDH1A1 (0.48) | NR1H2NR1H3KMT2AALDH1A1GLA | |
| SCHEMBL4667661 | 0.79 | ALDH1A1 (0.47) | NR1H2NR1H3KMT2AALDH1A1GLA | |
| SCHEMBL17515307 | 0.79 | NR1H2 (0.41) | NR1H2NR1H3KMT2AALDH1A1CHRNB2 | |
| SCHEMBL30489371 | 0.79 | KMT2A (0.55) | NR1H2NR1H3KMT2AALDH1A1TSHR |
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-3981883-A | Manufacture of 3-amino-2,1-benzisothiazoles | BASF AKTIENGESELLSCHAFT (DT) | 1976-09-21 | — | — | US | disclosed |