Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HAVCR2 | Q8TDQ0 | 1/20 | 0.65 |
| ▸ | GABRP | O00591 | 3/20 | 0.49 |
| ▸ | GABRD | O14764 | 3/20 | 0.49 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.49 |
| ▸ | GABRB1 | P18505 | 3/20 | 0.49 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.49 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.49 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.49 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.49 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.49 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.49 |
| ▸ | GABRA4 | P48169 | 3/20 | 0.49 |
| ▸ | GABRE | P78334 | 3/20 | 0.49 |
| ▸ | GABRA6 | Q16445 | 3/20 | 0.49 |
| ▸ | GABRG1 | Q8N1C3 | 3/20 | 0.49 |
| ▸ | GABRG3 | Q99928 | 3/20 | 0.49 |
| ▸ | GABRQ | Q9UN88 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9655531 | 0.84 | HAVCR2 (0.44) | HAVCR2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL440812 | 0.83 | KMT2A (0.70) | HAVCR2KMT2ANPC1RAB9A | |
| SCHEMBL436434 | 0.82 | HAVCR2 (0.68) | HAVCR2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL437026 | 0.79 | HAVCR2 (0.68) | HAVCR2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL436633 | 0.79 | HAVCR2 (0.68) | HAVCR2KMT2ANPC1RAB9ABTK | |
| SCHEMBL436716 | 0.79 | HAVCR2 (1.00) | HAVCR2KMT2ANPC1RAB9ABTK | |
| SCHEMBL10126289 | 0.79 | HAVCR2 (0.68) | HAVCR2BTKPARP1 | |
| SCHEMBL439862 | 0.78 | HAVCR2 (0.63) | HAVCR2KMT2A | |
| SCHEMBL22492438 | 0.77 | KDM4E (0.64) | RAB9AKDM4ECLCN2 | |
| SCHEMBL437613 | 0.77 | GABRA1 (0.41) | HAVCR2GABRA1GABRG2GABRB3GABRA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20120065166-A1 | Bone Modulators And Methods Therewith | ESPINA VIRGINIA (US) | 2012-03-15 | — | — | US | disclosed |
| EP-0245054-B1 | QUINOLINE AMIDES | ICI AMERICAS INC. (US) | 1991-08-07 | — | — | EP | disclosed |
| US-4904651-A | Anxiolytic 4-aminoquinoline-3-carboxamides | ICI AMERICAS INC. (US) | 1990-02-27 | — | — | US | disclosed |
| EP-0245054-A1 | Quinoline amides | ICI AMERICAS INC. (US) | 1987-11-11 | — | — | EP | disclosed |