Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GABRP | O00591 | 2/20 | 0.31 |
| ▸ | GABRD | O14764 | 2/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.31 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.31 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.31 |
| ▸ | GABRE | P78334 | 2/20 | 0.31 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.31 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.31 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.31 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL887209 | 0.73 | CYP1A2 (0.41) | CYP1A2 | |
| SCHEMBL29733309 | 0.66 | CYP1A2 (0.46) | CYP1A2GABRA5GABRB2HSD17B10GABRR1 | |
| SCHEMBL7410016 | 0.62 | GABRR1 (0.42) | CYP1A2GABRA5GABRB2HSD17B10GABRR1 | |
| SCHEMBL11564617 | 0.61 | CYP1A2 (0.46) | CYP1A2GABRA5GABRB2HSD17B10 | |
| SCHEMBL28633067 | 0.61 | LMNA (0.41) | CYP1A2GABRA5GABRB2HSD17B10GABRR1 | |
| SCHEMBL27938878 | 0.61 | CYP1A2 (1.00) | CYP1A2GABRA5GABRB2HSD17B10GABRR1 | |
| SCHEMBL7122558 | 0.61 | CYP1A2 (0.67) | CYP1A2GABRA5GABRB2HSD17B10GABRR1 | |
| SCHEMBL2211570 | 0.60 | CYP1A2 (0.42) | CYP1A2GABRA5GABRB2GABRR1LMNA | |
| SCHEMBL11531261 | 0.60 | GABRR1 (0.36) | GABRA5GABRB2GABRR1LMNAGABRA1 | |
| SCHEMBL16499267 | 0.60 | CYP1A2 (0.42) | CYP1A2GABRA5GABRB2HSD17B10GABRR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1021910-C | LANKACIDIN DERIVATIVES AND PRODUCTION THEREOF | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1993-08-25 | — | — | CN | disclosed |