Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | MMP14 | P50281 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13844280 | 0.94 | CYP3A4 (0.42) | CYP3A4ALDH1A1TSHRTDP1ATM | |
| SCHEMBL13844250 | 0.92 | CYP3A4 (0.40) | CYP3A4ALDH1A1TSHRTDP1ATM | |
| SCHEMBL17816459 | 0.85 | CYP3A4 (0.43) | CYP3A4ALDH1A1TSHRTDP1ATM | |
| SCHEMBL13844362 | 0.81 | ALDH1A1 (0.36) | CYP3A4ALDH1A1TSHRTDP1ATM | |
| SCHEMBL13844238 | 0.80 | ALDH1A1 (0.34) | CYP3A4ALDH1A1TSHRTDP1ATM | |
| SCHEMBL14278859 | 0.80 | CYP3A4 (0.46) | CYP3A4ALDH1A1TSHRTDP1ATM | |
| SCHEMBL13924015 | 0.79 | USP2 (0.53) | CYP3A4 | |
| SCHEMBL1626697 | 0.77 | CYP3A4 (0.44) | CYP3A4ALDH1A1TSHRTDP1ATM | |
| SCHEMBL101962 | 0.77 | CYP3A4 (0.56) | CYP3A4ALDH1A1TSHRTDP1ATM | |
| SCHEMBL1629758 | 0.76 | CYP3A4 (0.43) | CYP3A4ALDH1A1TSHRTDP1ATM |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1702913-B1 | Blowing catalyst compositions containing hydroxyl and surface active groups for the production of polyurethane foams | AIR PROD & CHEM (US) | 2009-05-13 | — | — | EP | disclosed |
| US-7495131-B2 | Blowing catalyst compositions containing hydroxyl and surface active groups for the production of polyurethane foams | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2009-02-24 | — | — | US | disclosed |
| US-7495131-B2 | Blowing catalyst compositions containing hydroxyl and surface active groups for the production of polyurethane foams | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2009-02-24 | — | — | US | disclosed |