Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CSNK2A1 | P68400 | 7/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4689675 | 1.00 | CSNK2A1 (0.55) | CSNK2A1LMNATP53MRGPRX4CYP1A2 | |
| SCHEMBL4686037 | 0.82 | KDM4E (0.58) | CYP1A2KDM4E | |
| SCHEMBL4685167 | 0.82 | KDM4E (0.58) | CYP1A2KDM4E | |
| SCHEMBL10432959 | 0.81 | CYP1A2 (0.62) | LMNAMRGPRX4CYP1A2NPSR1CYP2D6 | |
| SCHEMBL4550411 | 0.80 | CSNK2A1 (0.59) | CSNK2A1LMNATP53MRGPRX4GLA | |
| SCHEMBL8301208 | 0.79 | LMNA (0.52) | CSNK2A1LMNATP53CYP1A2NPSR1 | |
| Hydrochloric Acid SCHEMBL2716247 | 0.78 | CSNK2A1 (0.60) | CSNK2A1LMNATP53MRGPRX4GLA | |
| SCHEMBL12677544 | 0.78 | NPSR1 (0.68) | LMNACYP1A2NPSR1CYP2D6KDM4E | |
| SCHEMBL12677545 | 0.78 | NPSR1 (0.68) | LMNACYP1A2NPSR1CYP2D6KDM4E | |
| SCHEMBL9110891 | 0.78 | KMT2A (0.50) | LMNATP53CYP1A2NPSR1CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1805163-B1 | 1,1A,5,5A-TETRAHYDRO-3-THIA-CYCLOPROPA[A]PENTALENES: TRICYCLIC THIOPHENE DERIVATIVES AS S1P1/EDG1 RECEPTOR AGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2008-10-01 | — | — | EP | claimed |