Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.64 |
| ▸ | TSHR | P16473 | 2/20 | 0.64 |
| ▸ | GAA | P10253 | 2/20 | 0.64 |
| ▸ | THRB | P10828 | 1/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 6/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.61 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | PTPRC | P08575 | 3/20 | 0.57 |
| ▸ | S100A4 | P26447 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 4/20 | 0.55 |
| ▸ | MAPT | P10636 | 4/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.55 |
| ▸ | GFER | P55789 | 2/20 | 0.51 |
| ▸ | BCHE | P06276 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5852345 | 0.88 | CYP3A4 (0.56) | CYP3A4TSHRGAATHRBTDP1 | |
| SCHEMBL29353815 | 0.86 | CYP3A4 (0.69) | CYP3A4TSHRGAATHRBTDP1 | |
| SCHEMBL78293 | 0.86 | CYP3A4 (0.69) | CYP3A4TSHRGAATHRBTDP1 | |
| SCHEMBL3120559 | 0.85 | RAB9A (0.58) | CYP3A4TSHRGAATHRBTDP1 | |
| SCHEMBL6869307 | 0.84 | CYP3A4 (0.62) | CYP3A4TSHRGAATHRBTDP1 | |
| SCHEMBL29214106 | 0.84 | PTPRC (0.54) | CYP3A4TSHRGAATHRBTDP1 | |
| Hydrochloric Acid SCHEMBL970605 | 0.84 | CYP3A4 (0.67) | CYP3A4TSHRGAATHRBTDP1 | |
| SCHEMBL11684415 | 0.84 | TDP1 (0.65) | CYP3A4TSHRGAATHRBTDP1 | |
| SCHEMBL31435677 | 0.84 | CYP3A4 (0.67) | CYP3A4TSHRGAATHRBTDP1 | |
| Methane SCHEMBL28785435 | 0.84 | CYP3A4 (0.67) | CYP3A4TSHRGAATHRBTDP1 |
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-4808723-A | Process for the preparation of benzothiazoles | BAYER AKTIENGESELLSCHAFT (DE) | 1989-02-28 | — | — | US | disclosed |