Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | GPR132 | Q9UNW8 | 1/20 | 0.38 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.37 |
| ▸ | CCKAR | P32238 | 2/20 | 0.36 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.35 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL934867 | 0.85 | KDM4E (0.37) | KDM4ELPAR1MAPT | |
| SCHEMBL2491639 | 0.78 | MCL1 (0.43) | KDM4EALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL912923 | 0.77 | NOTUM (0.44) | KDM4EALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL2488907 | 0.75 | LPAR1 (0.39) | KDM4ELPAR1MAPTLMNA | |
| Hydrochloric Acid SCHEMBL544080 | 0.75 | LPAR1 (0.38) | KDM4ELPAR1MAPTLMNA | |
| Hydrochloric Acid SCHEMBL544865 | 0.75 | LPAR1 (0.38) | KDM4ELPAR1MAPTLMNA | |
| Hydrochloric Acid SCHEMBL544409 | 0.72 | LPAR1 (0.40) | KDM4ELPAR1MAPT | |
| Hydrochloric Acid SCHEMBL544874 | 0.72 | CTSA (0.35) | LPAR1LMNA | |
| SCHEMBL544584 | 0.72 | NOTUM (0.51) | KDM4EPTGER1MAPTSMN1; SMN2MEN1 | |
| Hydrochloric Acid SCHEMBL544508 | 0.71 | PAICS (0.37) | KDM4ELPAR1MAPT |
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-2011007090-A1 | DERIVATIVES OF 5,6-BISARYL-2-PYRIMIDINE-CARBOXAMIDE, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF AS UROTENSIN-II RECEPTOR ANTAGONISTS | SANOFI-AVENTIS (FR) | 2011-01-20 | — | — | WO | disclosed |