Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5510643 | 0.76 | ALDH1A1 (0.44) | KMT2ASMN1; SMN2MEN1CYP2C9CYP2C19 | |
| SCHEMBL25336401 | 0.76 | ALDH1A1 (0.47) | KMT2ASMN1; SMN2MEN1ALDH1A1TSHR | |
| SCHEMBL5512049 | 0.76 | ALDH1A1 (0.47) | KMT2ASMN1; SMN2MEN1ALDH1A1TSHR | |
| SCHEMBL13603966 | 0.74 | ALDH1A1 (0.46) | KMT2ASMN1; SMN2MEN1CYP2C9CYP2C19 | |
| SCHEMBL5932403 | 0.74 | ALDH1A1 (0.46) | KMT2ASMN1; SMN2MEN1CYP2C9CYP2C19 | |
| SCHEMBL29024419 | 0.74 | TP53 (0.42) | KMT2ASMN1; SMN2MEN1CYP2C9CYP2C19 | |
| SCHEMBL13603962 | 0.73 | TP53 (0.61) | KMT2ASMN1; SMN2MEN1ALDH1A1TSHR | |
| SCHEMBL5932829 | 0.73 | ALDH1A1 (0.44) | KMT2ASMN1; SMN2MEN1CYP2C9CYP2C19 | |
| SCHEMBL5932823 | 0.73 | ALDH1A1 (0.44) | KMT2ASMN1; SMN2MEN1CYP2C9CYP2C19 | |
| SCHEMBL8392178 | 0.73 | ALDH1A1 (0.44) | KMT2ASMN1; SMN2MEN1CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1981837-A2 | METHODS AND COMPOSITIONS FOR MODULATING SPHINGOSINE-1-PHOSPHATE (S1P) RECEPTOR ACTIVITY | Praecis Pharmaceuticals Incorporated (US) | 2008-10-22 | — | — | EP | disclosed |
| WO-2007092190-A2 | METHODS AND COMPOSITIONS FOR MODULATING SPHINGOSINE-1-PHOSPHATE (S1P) RECEPTOR ACTIVITY | PRAECIS PHARMACEUTICALS, INC. (US) | 2007-08-16 | — | — | WO | disclosed |