Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | ACLY | P53396 | 5/20 | 0.34 |
| ▸ | CNR1 | P21554 | 4/20 | 0.34 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.34 |
| ▸ | KMO | O15229 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2967385 | 0.75 | CYP3A4 (0.42) | CYP3A4CYP2D6ACLYCNR1SLC22A12 | |
| SCHEMBL2846115 | 0.73 | PSEN1 (0.46) | CYP3A4CYP2D6ACLYMAPT | |
| SCHEMBL4570714 | 0.61 | ADRB2 (0.32) | ACLY | |
| SCHEMBL17927652 | 0.60 | KMT2A (0.41) | KMT2AMEN1ALDH1A1HPGDHTT | |
| SCHEMBL1272497 | 0.59 | MAPT (0.50) | KMT2AMEN1ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL29136975 | 0.59 | LMNA (0.43) | CYP3A4CYP2D6KMT2AMEN1ALDH1A1 | |
| SCHEMBL3960290 | 0.56 | KMT2A (0.42) | KMT2AMEN1ALDH1A1HPGDHTT | |
| SCHEMBL31713546 | 0.55 | MEN1 (0.39) | KMT2AMEN1ALDH1A1HPGDTSHR | |
| SCHEMBL22003888 | 0.55 | ACLY (0.67) | ACLY | |
| SCHEMBL7011123 | 0.54 | SLC9A1 (0.54) | KMT2AMEN1ALDH1A1HTTSMN1; SMN2 |
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-2125718-B1 | NEW SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS | BOEHRINGER INGELHEIM INT (DE) | 2010-09-15 | — | — | EP | disclosed |