Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 4/20 | 0.38 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.35 |
| ▸ | GABRD | O14764 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.35 |
| ▸ | GABRE | P78334 | 1/20 | 0.35 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.35 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.35 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.35 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.35 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2473185 | 0.83 | ACACB (0.37) | ACACBSYKGABRPGABRDGABRA1 | |
| SCHEMBL883726 | 0.80 | LOX (0.48) | GRIN2DGRIN3BCHRM1ADRA1DADRA1A | |
| Hydrochloric Acid SCHEMBL4071650 | 0.78 | LOX (0.47) | GRIN2DGRIN3BCHRM1ADRA1DADRA1A | |
| SCHEMBL14923434 | 0.78 | NUDT1 (0.51) | ACACBGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL13866399 | 0.78 | HTR7 (0.43) | — | |
| Hydrochloric Acid SCHEMBL4090480 | 0.78 | EPHX2 (0.42) | GAASMN1; SMN2LMNAHTT | |
| SCHEMBL19030677 | 0.78 | FERMT2 (0.40) | ACACBSYKGAALOXLOXL2 | |
| Hydrochloric Acid SCHEMBL4090481 | 0.78 | EPHX2 (0.42) | GAASMN1; SMN2LOXLOXL2LMNA | |
| SCHEMBL164636 | 0.76 | ACACB (0.37) | ACACBGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL14076723 | 0.74 | LOXL2 (0.43) | ACACBSMN1; SMN2LOXLOXL2HTT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113692304-A | 1- ((2- (2,2, 2-trifluoroethoxy) pyridin-4-yl) methyl) urea derivatives as KCNQ enhancers | 礼来公司 | 2021-11-23 | — | — | CN | disclosed |
| EP-1740551-A1 | HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF AS AN MMP-13 INHIBITOR | Takeda Pharmaceutical Company Limited (JP) | 2007-01-10 | — | — | EP | disclosed |
| WO-2005105760-A1 | HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF AS AN MMP-13 INHIBITOR | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2005-11-10 | — | — | WO | disclosed |