Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 2/20 | 0.42 |
| ▸ | CNR2 | P34972 | 2/20 | 0.42 |
| ▸ | ESRRG | P62508 | 2/20 | 0.42 |
| ▸ | ESRRB | O95718 | 1/20 | 0.42 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | CTSG | P08311 | 1/20 | 0.39 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.39 |
| ▸ | CMA1 | P23946 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL1503540 | 0.87 | ALDH1A1 (0.53) | ALDH1A1MEN1KMT2APKMCNR1 | |
| SCHEMBL1504684 | 0.84 | ALDH1A1 (0.42) | NPC1ALDH1A1MEN1KMT2APKM | |
| SCHEMBL1503623 | 0.80 | ALDH1A1 (0.46) | NPC1ALDH1A1MEN1KMT2AADAM17 | |
| SCHEMBL1503688 | 0.79 | ADAM17 (0.72) | PKMADAM17HTT | |
| SCHEMBL2681243 | 0.77 | ALDH1A1 (0.43) | ALDH1A1MEN1KMT2ALMNAMAPT | |
| SCHEMBL1503654 | 0.77 | ADAM17 (0.61) | ALDH1A1ADAM17LMNA | |
| SCHEMBL12077180 | 0.77 | ADAM17 (0.60) | NPC1ALDH1A1PKMCNR1CNR2 | |
| SCHEMBL24871621 | 0.73 | ESRRG (0.55) | NPC1ALDH1A1MEN1KMT2AESRRG | |
| SCHEMBL18652186 | 0.73 | ESRRG (0.55) | NPC1ALDH1A1MEN1KMT2ACNR1 | |
| SCHEMBL6207632 | 0.71 | CYP2D6 (0.54) | ALDH1A1MEN1KMT2ANPSR1CYP1A2 |
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-2011033010-A1 | 4-ALKOXY-N- (2-HYDROXYCARBAMOYL-2-PIPERIDINYL-ETHYL) -BENZAMIDE COMPOUNDS AS SELECTIVE TACE-INHIBITORS FOR THE TREATMENT OF INFLAMMATORY DISEASES | GALDERMA RESEARCH & DEVELOPMENT (FR) | 2011-03-24 | — | — | WO | disclosed |