Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CTSK | P43235 | 5/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | FDPS | P14324 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3617251 | 0.92 | CA1 (0.50) | CA1FDPSACE2 | |
| SCHEMBL28198656 | 0.92 | CA1 (0.50) | CA1FDPSACE2 | |
| SCHEMBL5560875 | 0.88 | SMN1; SMN2 (0.37) | CA1CA2CTSKTSHRSMN1; SMN2 | |
| SCHEMBL27846784 | 0.85 | FAAH (0.46) | ATMCYP3A4 | |
| SCHEMBL12158831 | 0.82 | TSHR (0.45) | CA1CA2CTSKTSHRFDPS | |
| Ethane SCHEMBL27996835 | 0.81 | TSHR (0.44) | CA1CA2CTSKTSHRFDPS | |
| SCHEMBL28124826 | 0.80 | GPR84 (0.44) | CA1CA2CTSKTSHRSMN1; SMN2 | |
| SCHEMBL4601896 | 0.79 | BLM (0.36) | CA1TSHRTDP1 | |
| SCHEMBL5722200 | 0.79 | — | — | |
| SCHEMBL22773828 | 0.79 | CA1 (0.50) | CA1CA2TSHRSLC15A1FDPS |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0877728-B1 | PROCESS FOR THE CARBONYLATION OF ACETYLENICALLY UNSATURATED COMPOUNDS | SHELL INT RESEARCH (NL) | 2000-04-05 | — | — | EP | disclosed |
| US-5952522-A | CATALYZING THE REACTION WITH CARBON MONOXIDE AND A CO-REACTANT IN THE PRESENCE OF A CATALYST SYSTEM COMPRISING A SOURCE OF PLATINUM, A BIDENTATE LIGAND AND A SOURCE OF ANIONS | SHELL OIL COMPANY (US) | 1999-09-14 | — | — | US | disclosed |
| EP-0877728-A1 | PROCESS FOR THE CARBONYLATION OF ACETYLENICALLY UNSATURATED COMPOUNDS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1998-11-18 | — | — | EP | disclosed |
| WO-1997020803-A1 | PROCESS FOR THE CARBONYLATION OF ACETYLENICALLY UNSATURATED COMPOUNDS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1997-06-12 | — | — | WO | disclosed |