Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | STING1 | Q86WV6 | 7/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.32 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9537166 | 0.87 | STING1 (0.33) | ALDH1A1STING1LMNAKMT2ATSHR | |
| SCHEMBL9538258 | 0.83 | CYP2A6 (0.44) | ALDH1A1STING1KMT2ATSHRHSD17B10 | |
| SCHEMBL7032744 | 0.82 | STING1 (0.45) | ALDH1A1STING1ACHEPDE4A | |
| SCHEMBL9541062 | 0.81 | STING1 (0.36) | ALDH1A1STING1KMT2ATSHRHSD17B10 | |
| SCHEMBL9538537 | 0.78 | STING1 (0.43) | ALDH1A1STING1KMT2ATSHRHSD17B10 | |
| SCHEMBL10271885 | 0.77 | KDM4E (0.39) | ALDH1A1STING1LMNAKMT2ATSHR | |
| SCHEMBL9538461 | 0.75 | STING1 (0.47) | STING1TSHRHSD17B10CYP3A4GLA | |
| SCHEMBL9541789 | 0.74 | TSHR (0.40) | STING1LMNAKMT2ATSHRHSD17B10 | |
| SCHEMBL9540466 | 0.73 | PPARG (0.40) | STING1TSHRCYP3A4TDP1ACHE | |
| SCHEMBL9540660 | 0.73 | CYP3A4 (0.39) | STING1TSHRCYP3A4ACHE |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993005033-A1 | BENZO[b]THIOPHENE DERIVATES, PROCESS FOR PRODUCING THE SAME AND MEDICAMENTS CONTAINING THEM | BOEHRINGER MANNHEIM GMBH (DE) | 1993-03-18 | — | — | WO | disclosed |