Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | AKR1C3 | P42330 | 5/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL4058118 | 0.92 | ALDH1A1 (0.60) | ALDH1A1SMN1; SMN2TDP1CYP2C19LMNA | |
| SCHEMBL26731607 | 0.89 | CYP2C19 (0.70) | ALDH1A1TDP1CYP2C19PKMMAPK1 | |
| SCHEMBL2850679 | 0.88 | CYP2C19 (0.53) | ALDH1A1TDP1CYP2C19PKMMAPK1 | |
| SCHEMBL26731616 | 0.86 | CYP2C19 (0.52) | ALDH1A1CYP2C19LMNAPKMMAPK1 | |
| SCHEMBL4237644 | 0.83 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2CYP2C19PKMMAPK1 | |
| SCHEMBL4237642 | 0.83 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2CYP2C19PKMMAPK1 | |
| SCHEMBL14973141 | 0.83 | MEP1B (0.50) | ALDH1A1CYP2C19PKMMAPK1TSHR | |
| SCHEMBL11539772 | 0.82 | TSHR (0.65) | ALDH1A1SMN1; SMN2LMNAPKMMAPK1 | |
| SCHEMBL2560714 | 0.82 | ALDH1A1 (0.72) | ALDH1A1SMN1; SMN2TDP1CYP2C19LMNA | |
| SCHEMBL4233646 | 0.82 | ALDH1A1 (0.64) | ALDH1A1SMN1; SMN2TDP1CYP2C19LMNA |
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-2009111260-A1 | PHENYLSULFONAMIDE-SUBSTITUTED, PYRAZOLO[1, 5-A]PYRIMIDINES, METHODS FOR PREPARATION AND USES THEREOF | WYETH (US) | 2009-09-11 | — | — | WO | disclosed |