Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 4/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | AGER | Q15109 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | APAF1 | O14727 | 1/20 | 0.34 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.31 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.31 |
| ▸ | TNF | P01375 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL8504140 | 0.74 | CYP11B1 (0.34) | CYP11B1CYP11B2HSD17B10MEN1HPGD | |
| SCHEMBL10873867 | 0.72 | KCNMA1 (0.43) | CYP11B1CYP11B2HSD17B10MEN1HPGD | |
| SCHEMBL9678510 | 0.71 | FGFR1 (0.47) | HPGDMAPK1HTT | |
| SCHEMBL6529410 | 0.69 | CYP11B1 (0.53) | CYP11B1CYP11B2SMN1; SMN2ASAH1TDP1 | |
| SCHEMBL9060998 | 0.68 | TDP1 (0.48) | CYP11B1CYP11B2HSD17B10MEN1HPGD | |
| SCHEMBL8412995 | 0.67 | MEN1 (0.47) | CYP11B1CYP11B2HSD17B10MEN1HPGD | |
| SCHEMBL3377470 | 0.67 | RAB9A (0.57) | HSD17B10MEN1HPGDKMT2ASMN1; SMN2 | |
| SCHEMBL8176074 | 0.67 | AOC3 (0.37) | TDP1TSHR | |
| SCHEMBL8792548 | 0.66 | TDP1 (0.46) | CYP11B1CYP11B2HSD17B10MEN1HPGD | |
| SCHEMBL599672 | 0.66 | POLB (0.45) | CYP11B1CYP11B2MEN1HPGDKMT2A |
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-5948789-A | ASYMMETRIC OXIDATION OF A PRO-CHIRAL SULPHIDE TO THE SINGLE ENANTIOMERS OR AN ENANTIOMERICALLY ENRICHED FORM OF THE CORRESPONDING SULPHOXIDE. OPTICALLY PURE SUBSTITUTED 2-(2-PYRIDINYLMETHYL-SULPHINYL)-1H-BENZIMIDAZOLES. | ASTRA AKTIEBOLAG (SE) | 1999-09-07 | — | — | US | disclosed |