Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | CUL4A | Q13619 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 7/20 | 0.33 |
| ▸ | TP53 | P04637 | 4/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | CDKN1A | P38936 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | CFTR | P13569 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL7357771 | 0.91 | KDR (0.38) | KDRUSP2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7350946 | 0.82 | CUL4A (0.39) | KDRUSP2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7357462 | 0.81 | MAPT (0.42) | KDRGAAMAPTTP53LMNA | |
| SCHEMBL7354835 | 0.79 | CUL4A (0.36) | CUL4AALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL7351971 | 0.73 | MAPT (0.34) | KDRUSP2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7359596 | 0.70 | MEN1 (0.40) | MAPTEGFRALDH1A1MEN1KMT2A | |
| SCHEMBL7357765 | 0.65 | KDR (0.35) | KDRUSP2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7357469 | 0.63 | PIM1 (0.46) | KDRUSP2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL4114434 | 0.62 | HTR7 (0.67) | KDRUSP2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL4286367 | 0.62 | LMNA (0.67) | KDRUSP2CYP1A2CYP2D6CYP2C9 |
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 2 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 |