Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL107809 | 0.85 | TDP1 (0.50) | ALDH1A1CYP3A4TDP1MAPK1L3MBTL1 | |
| SCHEMBL4966265 | 0.85 | MAPT (0.40) | ALDH1A1CYP3A4TDP1MAPK1L3MBTL1 | |
| SCHEMBL8629718 | 0.80 | TDP1 (0.45) | ALDH1A1CYP3A4TDP1MAPK1L3MBTL1 | |
| SCHEMBL7639625 | 0.77 | CYP3A4 (0.50) | ALDH1A1CYP3A4TDP1MAPK1L3MBTL1 | |
| SCHEMBL15313074 | 0.75 | ALDH1A1 (0.33) | ALDH1A1CYP3A4TDP1MAPK1L3MBTL1 | |
| SCHEMBL7745814 | 0.72 | TDP1 (0.48) | ALDH1A1CYP3A4TDP1MAPK1L3MBTL1 | |
| SCHEMBL7647702 | 0.71 | ALDH1A1 (0.39) | ALDH1A1CYP3A4TDP1MAPK1L3MBTL1 | |
| SCHEMBL12304288 | 0.71 | ALDH1A1 (0.31) | ALDH1A1CYP3A4TDP1MAPK1L3MBTL1 | |
| SCHEMBL28544063 | 0.69 | CYP3A4 (0.45) | ALDH1A1CYP3A4TDP1MAPK1L3MBTL1 | |
| SCHEMBL14487139 | 0.69 | MAPT (0.43) | ALDH1A1CYP3A4TDP1MAPK1L3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1943283-A1 | POLYURETHANE-UREA ELASTOMERS | Bayer MaterialScience LLC (US) | 2008-07-16 | — | — | EP | disclosed |
| WO-2007050542-A1 | POLYURETHANE-UREA ELASTOMERS | BAYER MATERIALSCIENCE LLC (US) | 2007-05-03 | — | — | WO | disclosed |