Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | IDH1 | O75874 | 1/20 | 0.34 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 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 | |
|---|---|---|---|---|
| SCHEMBL9719503 | 0.90 | IDH1 (0.39) | CA2CA1CA4CA6KMT2A | |
| SCHEMBL9719429 | 0.83 | SLC6A2 (0.43) | MAPTTSHRIDH1 | |
| SCHEMBL9719495 | 0.82 | GFER (0.35) | ESR1ESR2GAAMAPTKDM4E | |
| SCHEMBL9090377 | 0.78 | CA1 (0.33) | CA2CA1TSHR | |
| SCHEMBL9320710 | 0.78 | TSHR (0.38) | CA2CA1CA4CA6TSHR | |
| SCHEMBL7801458 | 0.78 | — | — | |
| SCHEMBL9719496 | 0.77 | IDH1 (0.31) | IDH1 | |
| Hydrochloric Acid SCHEMBL9091024 | 0.76 | — | — | |
| SCHEMBL9719476 | 0.75 | SLC6A2 (0.31) | — | |
| SCHEMBL9092587 | 0.72 | XDH (0.52) | KMT2ACYP3A4MEN1GAAMAPT |
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 |