Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.69 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.69 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.69 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.69 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.64 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.64 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.64 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.64 |
| ▸ | CCKBR | P32239 | 1/20 | 0.64 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.64 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.64 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.64 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.58 |
| ▸ | GAA | P10253 | 2/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL8851595 | 0.91 | GABRA1 (0.68) | HDAC3HDAC1HDAC8HDAC6GABRA1 | |
| SCHEMBL7541208 | 0.85 | GABRA1 (0.68) | HDAC3HDAC1HDAC8HDAC6GABRA1 | |
| SCHEMBL6949881 | 0.85 | SMN1; SMN2 (0.63) | HDAC3HDAC1HDAC8HDAC6GABRA1 | |
| SCHEMBL1368126 | 0.84 | HDAC3 (0.78) | HDAC3HDAC1HDAC8HDAC6GABRA1 | |
| SCHEMBL6985755 | 0.84 | GABRA1 (0.65) | HDAC3HDAC1HDAC8HDAC6GABRA1 | |
| SCHEMBL7858451 | 0.83 | HDAC3 (0.63) | HDAC3HDAC1HDAC8HDAC6GABRA1 | |
| SCHEMBL11576361 | 0.81 | GABRA1 (0.62) | HDAC3HDAC1HDAC8HDAC6GABRA1 | |
| SCHEMBL1367380 | 0.81 | HDAC3 (0.98) | HDAC3HDAC1HDAC8HDAC6 | |
| SCHEMBL1365810 | 0.81 | HDAC3 (0.98) | HDAC3HDAC1HDAC8HDAC6 | |
| SCHEMBL11577126 | 0.81 | GABRA1 (0.61) | HDAC3HDAC1HDAC8HDAC6GABRA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0387618-B1 | 1,7-Fused 1H-indole-2-carboxylic N-(1,4-benzodiazepin-3-yl)-amides | KALI CHEMIE PHARMA GMBH (DE) | 1994-07-27 | — | — | EP | disclosed |
| US-5010076-A | Cholecystokinin antagonist | KALI-CHEMIE PHARMA GMBH (DE) | 1991-04-23 | — | — | US | disclosed |
| EP-0387618-A1 | 1,7-Fused 1H-indole-2-carboxylic N-(1,4-benzodiazepin-3-yl)-amides | Kali-Chemie Pharma GmbH (DE) | 1990-09-19 | — | — | EP | disclosed |