Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SCN4A | P35499 | 2/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.36 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.36 |
| ▸ | BPTF | Q12830 | 1/20 | 0.36 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | VDR | P11473 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4684041 | 0.86 | S1PR1 (0.46) | TSHRS1PR1S1PR3LMNA | |
| SCHEMBL4684045 | 0.86 | S1PR1 (0.46) | TSHRS1PR1S1PR3LMNA | |
| SCHEMBL4687491 | 0.78 | TSHR (0.46) | TSHRLMNAHTTNCOA1NCOA3 | |
| SCHEMBL4688494 | 0.77 | SCN4A (0.42) | TSHRS1PR1S1PR3LMNASCN4A | |
| SCHEMBL4685422 | 0.77 | TSHR (0.45) | TSHRS1PR1S1PR3LMNAHTT | |
| SCHEMBL4687420 | 0.73 | TSHR (0.45) | TSHRLMNAHTTNCOA1NCOA3 | |
| SCHEMBL4096065 | 0.72 | TSHR (0.44) | TSHRLMNAHTTNCOA1NCOA3 | |
| SCHEMBL1005872 | 0.71 | TSHR (0.55) | TSHRHTTNCOA1NCOA3BPTF | |
| SCHEMBL13617706 | 0.71 | THRA (0.63) | TSHRS1PR1S1PR3LMNAHDAC6 | |
| SCHEMBL18471225 | 0.70 | SMN1; SMN2 (0.49) | TSHRHTTPARP10ALDH1A1SMN1; SMN2 |
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 |