Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA5 | P31644 | 2/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.34 |
| ▸ | GABRR2 | P28476 | 1/20 | 0.34 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.30 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.30 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23538172 | 0.77 | CCR1 (0.31) | — | |
| SCHEMBL27947650 | 0.75 | ADORA2A (0.42) | GABRA5GABRB2HSD17B10KDM4ELMNA | |
| SCHEMBL28062239 | 0.75 | AGBL2 (0.38) | GABRA5GABRB2HSD17B10ALDH1A1CYP3A4 | |
| SCHEMBL5302445 | 0.72 | GABRA5 (0.39) | GABRA5GABRB2HSD17B10ALDH1A1CYP3A4 | |
| SCHEMBL27912645 | 0.72 | GABRA5 (0.39) | GABRA5GABRB2HSD17B10ALDH1A1CYP3A4 | |
| SCHEMBL27808822 | 0.72 | GABRA5 (0.47) | GABRA5GABRB2HSD17B10ALDH1A1CYP3A4 | |
| SCHEMBL20116537 | 0.72 | GABRA5 (0.39) | GABRA5GABRB2HSD17B10ALDH1A1CYP3A4 | |
| SCHEMBL16369768 | 0.72 | HCAR2 (0.41) | HSD17B10ALDH1A1TSHRKDM4ELMNA | |
| SCHEMBL3293609 | 0.71 | IDH1 (0.37) | — | |
| SCHEMBL29010079 | 0.69 | LMNA (0.34) | GABRA5GABRB2HSD17B10ALDH1A1KDM4E |
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-105473560-A | Therapeutically active compounds and methods of use thereof | AGIOS PHARMACEUTICALS INC | 2016-04-06 | — | — | CN | disclosed |