Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.35 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.34 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.34 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.34 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | PARP1 | P09874 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7359596 | 0.80 | MEN1 (0.40) | ALDH1A1HPGDPARP1TSHRSMN1; SMN2 | |
| SCHEMBL7354835 | 0.76 | CUL4A (0.36) | ALDH1A1HPGDPARP1SMN1; SMN2MEN1 | |
| SCHEMBL7350946 | 0.69 | CUL4A (0.39) | GABRA1GABRG2GABRB3GABRA3ALDH1A1 | |
| SCHEMBL7349447 | 0.68 | GABRA1 (0.36) | GABRA1GABRG2GABRB3GABRA3CRBN | |
| SCHEMBL1140766 | 0.61 | PLD1 (0.47) | CRBNGRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL30477095 | 0.61 | CRBN (0.46) | GABRA1GABRG2GABRB3GABRA3CRBN | |
| SCHEMBL9667506 | 0.60 | ALDH1A1 (0.44) | GABRA1GABRG2GABRB3GABRA3CRBN | |
| SCHEMBL2567610 | 0.60 | GABRA1 (0.59) | GABRA1GABRG2GABRB3GABRA3ALDH1A1 | |
| SCHEMBL6353295 | 0.60 | PARP1 (0.54) | GABRA1GABRG2GABRB3GABRA3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL3827230 | 0.60 | PLD1 (0.46) | CRBNGRIN2DGRIN3BGRIN1GRIN2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5367077-A | Certain cycloalkyl and azacycloalkyl pyrrolopyridines; a new class of gaba rain receptor ligands | NEUROGEN CORPORATION (US) | 1994-11-22 | — | — | US | claimed |
| WO-1994025461-A1 | CERTAIN CYCLOALKYL AND AZACYCLOALKYL PYRROLOPYRIDINES; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS | NEUROGEN CORPORATION (US) | 1994-11-10 | — | — | WO | claimed |
| US-5367077-A | Certain cycloalkyl and azacycloalkyl pyrrolopyridines; a new class of gaba rain receptor ligands | NEUROGEN CORPORATION (US) | 1994-11-22 | — | — | US | disclosed |