Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.33 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.32 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3714866 | 1.00 | TSHR (0.47) | TSHRALOX15SMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL1175396 | 0.92 | TSHR (0.49) | TSHRALOX15SMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL1175393 | 0.92 | TSHR (0.49) | TSHRALOX15SMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL773113 | 0.82 | TSHR (0.60) | TSHRALOX15SMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL1176040 | 0.72 | S1PR1 (0.54) | — | |
| SCHEMBL1176038 | 0.72 | S1PR1 (0.54) | — | |
| SCHEMBL5965751 | 0.71 | ALDH1A1 (0.59) | TSHRALOX15SMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL5965750 | 0.71 | ALDH1A1 (0.59) | TSHRALOX15SMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL772719 | 0.71 | ALDH1A1 (0.59) | TSHRALOX15SMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL28040009 | 0.70 | PGR (0.32) | ALDH1A1KCNH2PGRHTT |
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-2222667-A2 | NOVEL THIOPHENE DERIVATIVES AS AGONISTS OF S1P1/EDG1 | Actelion Pharmaceuticals Ltd. (CH) | 2010-09-01 | — | — | EP | disclosed |
| WO-2009074950-A2 | THIOPHENE DERIVATIVES AS AGONISTS OF S1P1/EDG1 | ACTELION PHARMACEUTICALS LTD (CH) | 2009-06-18 | — | — | WO | disclosed |