Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 6/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 6/20 | 0.39 |
| ▸ | FOS | P01100 | 2/20 | 0.39 |
| ▸ | TTR | P02766 | 2/20 | 0.39 |
| ▸ | JUN | P05412 | 2/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.39 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | ESR1 | P03372 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27552892 | 0.98 | ALOX15 (0.38) | ALOX15ALOX12FOSTTRJUN | |
| SCHEMBL458330 | 0.79 | PTGS2 (0.42) | TP53CYP1A2PTGS2TRPA1 | |
| SCHEMBL5871513 | 0.77 | PTPRB (0.43) | ALOX15ALOX12ALDH1A1ESR1CYP3A4 | |
| SCHEMBL3367670 | 0.77 | LOXL2 (0.43) | TAAR1MAOBKDM4EMAPK1HTR2A | |
| SCHEMBL359220 | 0.77 | MAPT (0.38) | ALOX15ALOX12TTRRECQLHSD17B10 | |
| SCHEMBL28021341 | 0.76 | GABRA1 (0.34) | ALOX15ALOX12FOSTTRJUN | |
| SCHEMBL15067851 | 0.76 | GABRA1 (0.42) | ALOX15ALOX12FOSTTRJUN | |
| SCHEMBL1171484 | 0.76 | CNR1 (0.37) | GABRA1GABRB2TAAR1KDM4EALDH1A1 | |
| SCHEMBL7469143 | 0.75 | GABRA1 (0.41) | ALOX15ALOX12FOSTTRJUN | |
| SCHEMBL677764 | 0.75 | GABRA1 (0.41) | ALOX15ALOX12FOSTTRJUN |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011005295-A1 | MODULATORS OF THE SPHINGOSINE-1-PHOSPHATE (S1P) RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO | ARENA PHARMACEUTICALS, INC. (US) | 2011-01-13 | — | — | WO | claimed |
| WO-2011005295-A1 | MODULATORS OF THE SPHINGOSINE-1-PHOSPHATE (S1P) RECEPTOR USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO | ARENA PHARMACEUTICALS, INC. (US) | 2011-01-13 | — | — | WO | disclosed |