Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K1 | Q92918 | 8/20 | 0.47 |
| ▸ | CUL4A | Q13619 | 1/20 | 0.43 |
| ▸ | MGAM | O43451 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SI | P14410 | 1/20 | 0.41 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7354820 | 0.82 | HASPIN (0.38) | MGAMGAASIMGAM2KDM4E | |
| SCHEMBL7349812 | 0.80 | ALDH1A1 (0.42) | MAP4K1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL7356704 | 0.79 | KDM1A (0.40) | GAA | |
| SCHEMBL7356085 | 0.79 | CDKN1A (0.45) | — | |
| SCHEMBL8835550 | 0.79 | CUL4A (0.42) | MAP4K1CUL4A | |
| SCHEMBL9040921 | 0.79 | CUL4A (0.42) | MAP4K1CUL4AMGAMGAASI | |
| SCHEMBL7354450 | 0.77 | CBFB (0.44) | KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL20371736 | 0.76 | MAPT (0.39) | KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL7351375 | 0.76 | GABRA1 (0.61) | — | |
| SCHEMBL7357240 | 0.69 | CUL4A (0.44) | CUL4AGAAKDM4EALDH1A1SMN1; SMN2 |
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 4 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 |
| WO-1994025461-A1 | CERTAIN CYCLOALKYL AND AZACYCLOALKYL PYRROLOPYRIDINES; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS | NEUROGEN CORPORATION (US) | 1994-11-10 | — | — | WO | disclosed |