Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.32 |
| ▸ | BCL2 | P10415 | 1/20 | 0.31 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.31 |
| ▸ | CALM1 | P0DP23 | 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 | |
|---|---|---|---|---|
| SCHEMBL9719500 | 0.88 | HSPA5 (0.35) | — | |
| SCHEMBL9719496 | 0.87 | IDH1 (0.31) | KEAP1 | |
| SCHEMBL9719519 | 0.87 | BCL2 (0.33) | HTR2ASLC6A2SLC6A4SLC6A3BCL2 | |
| SCHEMBL9719476 | 0.86 | SLC6A2 (0.31) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9719425 | 0.84 | HSPA5 (0.37) | HTR2A | |
| SCHEMBL9719426 | 0.82 | SLC6A2 (0.35) | KEAP1HTR2ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9719465 | 0.82 | IDH1 (0.30) | — | |
| SCHEMBL9763059 | 0.74 | GABRA1 (0.31) | — | |
| SCHEMBL2495587 | 0.74 | MAOA (0.42) | HTR2ATSHRBCL2BCL2L1CALM1 | |
| SCHEMBL9763293 | 0.71 | TDP1 (0.34) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0227163-B1 | CROSSLINKABLE ELASTOMERIC COMPOSITIONS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1992-05-20 | — | — | EP | claimed |
| EP-0227163-A2 | Crosslinkable elastomeric compositions | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1987-07-01 | — | — | EP | claimed |
| EP-0227163-B1 | CROSSLINKABLE ELASTOMERIC COMPOSITIONS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1992-05-20 | — | — | EP | disclosed |
| US-4766180-A | Crosslinked elastomers containing benzocyclobutene derivatives as crosslinking agents | SHELL OIL COMPANY (US) | 1988-08-23 | — | — | US | disclosed |
| EP-0227163-A2 | Crosslinkable elastomeric compositions | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1987-07-01 | — | — | EP | disclosed |