Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 9/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 8/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 7/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 7/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HRH2 | P25021 | 4/20 | 0.36 |
| ▸ | HRH1 | P35367 | 4/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7920300 | 0.85 | CYP3A4 (0.41) | CYP2D6CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL20226245 | 0.85 | CYP2D6 (0.59) | CYP2D6CYP3A4KDM4ECYP19A1CYP2C9 | |
| SCHEMBL7920307 | 0.79 | TSHR (0.33) | L3MBTL1RAB9AHSD17B10MAPTTSHR | |
| SCHEMBL7920348 | 0.79 | CYP3A4 (0.44) | CYP2D6CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL16248363 | 0.77 | ALDH1A1 (0.41) | CYP2D6CYP3A4KDM4EALDH1A1CYP19A1 | |
| SCHEMBL7914003 | 0.76 | ACACB (0.32) | ALDH1A1MAPT | |
| SCHEMBL16248365 | 0.75 | ALDH1A1 (0.40) | CYP2D6CYP3A4KDM4EALDH1A1CYP19A1 | |
| SCHEMBL16248366 | 0.75 | ALDH1A1 (0.40) | CYP2D6CYP3A4KDM4EALDH1A1CYP19A1 | |
| SCHEMBL27317577 | 0.75 | KDM4E (0.36) | CYP2D6CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL10592137 | 0.75 | TDP1 (0.55) | CYP2D6CYP3A4KDM4EALDH1A1CYP19A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6217943-B1 | ADHESION AND REINFORCEMENT WITH SILANE CYANATE COUPLERS | 3M INNOVATIVE PROPERTIES COMPANY | 2001-04-17 | — | — | US | disclosed |
| US-5912377-A | CONTAINING AT LEAST ONE CYANATE ESTER GROUP AND HYDROLYZABLE SILYL GROUP; REINFORCED COMPOSITES, ADESIVES, COATINGS | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1999-06-15 | — | — | US | disclosed |
| EP-0830410-B1 | AROMATIC CYANATE ESTER SILANE COUPLING AGENTS | MINNESOTA MINING & MFG (US) | 1999-04-07 | — | — | EP | disclosed |
| EP-0830410-A1 | AROMATIC CYANATE ESTER SILANE COUPLING AGENTS | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1998-03-25 | — | — | EP | disclosed |
| WO-1996039457-A1 | AROMATIC CYANATE ESTER SILANE COUPLING AGENTS | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1996-12-12 | — | — | WO | disclosed |