Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | SCN1A | P35498 | 2/20 | 0.35 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.35 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4839336 | 0.84 | CYP2D6 (0.50) | CYP2D6CYP1A2CYP2C19LMNAMEN1 | |
| SCHEMBL3679560 | 0.84 | MEN1 (0.39) | CYP2D6CYP1A2CYP2C19LMNAMEN1 | |
| SCHEMBL4837043 | 0.83 | TSHR (0.49) | CYP2D6CYP1A2LMNASCN1ASCN2A | |
| SCHEMBL1784572 | 0.75 | CYP1A2 (0.49) | CYP2D6CYP1A2CYP2C19LMNAMEN1 | |
| SCHEMBL1785964 | 0.75 | TSHR (0.46) | CYP2D6CYP1A2LMNAMEN1KMT2A | |
| SCHEMBL31147033 | 0.74 | TSHR (0.42) | CYP2D6CYP1A2CYP2C19LMNAMEN1 | |
| SCHEMBL1784670 | 0.73 | LMNA (0.49) | CYP2D6CYP1A2LMNAMEN1KMT2A | |
| SCHEMBL1784641 | 0.73 | CYP2D6 (0.56) | CYP2D6CYP1A2CYP2C19LMNAMEN1 | |
| SCHEMBL25982607 | 0.73 | TSHR (0.50) | CYP2D6CYP1A2LMNAMEN1KMT2A | |
| SCHEMBL1788436 | 0.73 | TSHR (0.50) | CYP2D6CYP1A2CYP2C19LMNAMEN1 |
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 |