Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | ADRB2 | P07550 | 5/20 | 0.51 |
| ▸ | ADRB1 | P08588 | 5/20 | 0.51 |
| ▸ | ADRB3 | P13945 | 5/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | SCN1A | P35498 | 1/20 | 0.42 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.42 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.42 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6948344 | 0.85 | ALDH1A1 (0.54) | ALDH1A1ADRB2ADRB1ADRB3CYP2D6 | |
| SCHEMBL28354348 | 0.81 | CYP2D6 (0.54) | ALDH1A1ADRB2ADRB1ADRB3CYP2D6 | |
| SCHEMBL561394 | 0.78 | ALDH1A1 (0.60) | ALDH1A1ADRB2ADRB1ADRB3CYP2D6 | |
| SCHEMBL14955016 | 0.77 | ALDH1A1 (0.62) | ALDH1A1ADRB2ADRB1ADRB3CYP2D6 | |
| Benzoic Acid SCHEMBL28286154 | 0.77 | TSHR (0.50) | ALDH1A1ADRB2ADRB1ADRB3CYP2D6 | |
| SCHEMBL27470899 | 0.75 | ALDH1A1 (0.66) | ALDH1A1ADRB2ADRB1ADRB3CYP2D6 | |
| SCHEMBL14956200 | 0.75 | ALDH1A1 (0.65) | ALDH1A1ADRB2ADRB1ADRB3MAPK1 | |
| SCHEMBL561495 | 0.75 | ALDH1A1 (0.65) | ALDH1A1ADRB2ADRB1ADRB3MAPK1 | |
| SCHEMBL1754909 | 0.75 | ALDH1A1 (0.65) | ALDH1A1ADRB2ADRB1ADRB3MAPK1 | |
| SCHEMBL571219 | 0.74 | ALDH1A1 (0.69) | ALDH1A1ADRB2ADRB1ADRB3MAPK1 |
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-3486263-A2 | SELF-LIMITING CATALYST COMPOSITION WITH NO SILANE | W.R. Grace & CO. - CONN. (US) | 2019-05-22 | — | — | EP | disclosed |
| EP-2185600-B1 | SELF-LIMITING CATALYST COMPOSITION WITH NO SILANE | GRACE W R & CO (US) | 2018-10-31 | — | — | EP | disclosed |
| US-9796796-B2 | Self-limiting catalyst composition with No silane | W. R. GRACE & CO.-CONN. (US) | 2017-10-24 | — | — | US | disclosed |
| US-20110124491-A1 | Self-Limiting Catalyst Composition with No Silane | W. R. GRACE & CO.-CONN. | 2011-05-26 | — | — | US | disclosed |