Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRG2 | P18507 | 4/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.43 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 2/20 | 0.35 |
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
| ▸ | AKT2 | P31751 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | GPR139 | Q6DWJ6 | 2/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.31 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL6217150 | 0.76 | SMN1; SMN2 (0.33) | GABRG2GABRB3GABRA1GABRA3KDM4E | |
| SCHEMBL6216575 | 0.76 | TDP1 (0.33) | GABRG2GABRB3GABRA1GABRA3KDM4E | |
| SCHEMBL7225436 | 0.73 | MAPK1 (0.41) | KDM4ERAB9ANPC1ALDH1A1KDR | |
| SCHEMBL6217979 | 0.72 | GABRA1 (0.34) | GABRG2GABRB3GABRA1GABRA3 | |
| SCHEMBL31728622 | 0.71 | ADORA3 (0.42) | GABRG2GABRB3GABRA1GABRA3KDM4E | |
| SCHEMBL5771903 | 0.70 | GABRA1 (0.47) | GABRG2GABRB3GABRA1GABRA3GABRA5 | |
| SCHEMBL6221519 | 0.70 | GABRA1 (0.47) | GABRG2GABRB3GABRA1GABRA3GABRA5 | |
| SCHEMBL31208206 | 0.69 | TGFBR1 (0.52) | GABRA1KDM4ERAB9AALDH1A1MAPT | |
| SCHEMBL6219080 | 0.69 | GABRA1 (0.36) | GABRG2GABRB3GABRA1GABRA3ALDH1A1 | |
| SCHEMBL6221427 | 0.69 | GABRA1 (0.34) | GABRG2GABRB3GABRA1GABRA3 |
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 |
|---|---|---|---|---|---|---|---|
| US-6642229-B2 | Treatment of adverse neurological conditions | MERCK SHARP & DOHME LTD. | 2003-11-04 | — | — | US | disclosed |