Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | XBP1 | P17861 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MC4R | P32245 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.37 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL31276328 | 0.90 | MAOB (0.40) | IDO1MMP13ALDH1A1GAAAAK1 | |
| SCHEMBL25179496 | 0.86 | MMP13 (0.46) | MMP13ALDH1A1AAK1 | |
| SCHEMBL25270118 | 0.86 | MMP13 (0.46) | MMP13ALDH1A1AAK1 | |
| SCHEMBL31276734 | 0.86 | AAK1 (0.40) | MMP13SMN1; SMN2ALDH1A1GAAAAK1 | |
| SCHEMBL28396514 | 0.84 | CYP3A4 (0.49) | TP53SMN1; SMN2ALDH1A1HDAC8CYP3A4 | |
| SCHEMBL5322873 | 0.82 | ADORA1 (0.48) | MMP13CYP3A4CYP2C9GAA | |
| SCHEMBL5803685 | 0.82 | ADORA1 (0.48) | MMP13CYP3A4CYP2C9GAA | |
| SCHEMBL6557867 | 0.82 | ADORA1 (0.48) | MMP13CYP3A4CYP2C9GAA | |
| SCHEMBL21411564 | 0.82 | KEAP1 (0.50) | SMN1; SMN2MAPT | |
| SCHEMBL21431089 | 0.82 | KEAP1 (0.50) | SMN1; SMN2MAPT |
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-2007096186-A1 | SUBSTITUTED PHENYLPIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS | SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) | 2007-08-30 | — | — | WO | disclosed |