Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.43 |
| ▸ | LMNA | P02545 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | XBP1 | P17861 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1153371 | 0.94 | CYP1A2 (0.52) | CYP1A2CYP3A4CYP2C19FAAHHPGD | |
| SCHEMBL1154470 | 0.88 | CYP1A2 (0.64) | CYP1A2CYP3A4CYP2C19HPGDSMN1; SMN2 | |
| SCHEMBL11267257 | 0.80 | SMN1; SMN2 (0.49) | CYP1A2CYP3A4CYP2C19FAAHHPGD | |
| SCHEMBL11011149 | 0.78 | FAAH (0.65) | FAAHHPGDSMN1; SMN2LMNAMAPT | |
| SCHEMBL6098647 | 0.77 | CYP1A2 (0.64) | CYP1A2CYP3A4CYP2C19HPGDSMN1; SMN2 | |
| SCHEMBL30366462 | 0.76 | CYP1A2 (0.67) | CYP1A2CYP3A4CYP2C19HPGDSMN1; SMN2 | |
| SCHEMBL28980967 | 0.76 | CYP1A2 (0.67) | CYP1A2CYP3A4CYP2C19HPGDSMN1; SMN2 | |
| SCHEMBL1154276 | 0.75 | LMNA (0.56) | CYP1A2CYP3A4CYP2C19HPGDSMN1; SMN2 | |
| SCHEMBL11014396 | 0.74 | FAAH (0.48) | CYP1A2CYP3A4CYP2C19FAAHHPGD | |
| SCHEMBL11268476 | 0.74 | CYP1A2 (0.60) | CYP1A2CYP3A4CYP2C19HPGDSMN1; 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 |
|---|---|---|---|---|---|---|---|
| WO-2009101079-A1 | PYRIMIDYLMETHYL SULFONAMIDE COMPOUNDS | BASF SE (DE) | 2009-08-20 | — | — | WO | disclosed |