Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 6/20 | 0.51 |
| ▸ | CA12 | O43570 | 5/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 7/20 | 0.45 |
| ▸ | HTR1A | P08908 | 5/20 | 0.45 |
| ▸ | HTR2A | P28223 | 5/20 | 0.45 |
| ▸ | HTR7 | P34969 | 5/20 | 0.45 |
| ▸ | HTR6 | P50406 | 5/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 2/20 | 0.43 |
| ▸ | DRD5 | P21918 | 2/20 | 0.43 |
| ▸ | DRD3 | P35462 | 2/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | ELANE | P08246 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6324557 | 0.83 | CA9 (0.73) | CA9CA12CA2DRD2HTR1A | |
| SCHEMBL4033933 | 0.82 | CA9 (0.71) | CA9CA12CA2DRD2HTR1A | |
| SCHEMBL5354797 | 0.82 | CA9 (0.71) | CA9CA12CA2DRD2HTR1A | |
| SCHEMBL8973563 | 0.78 | CA9 (0.72) | CA9CA12CA2DRD2HTR1A | |
| SCHEMBL8880294 | 0.78 | KDM4E (0.69) | DRD2HTR1AHTR2AHTR7HTR6 | |
| SCHEMBL8881466 | 0.77 | KDM4E (0.67) | DRD2HTR1AHTR2AHTR7HTR6 | |
| SCHEMBL8970495 | 0.73 | HTR7 (0.42) | CA9CA12CA2DRD2HTR1A | |
| SCHEMBL6598227 | 0.73 | KDM4E (0.68) | DRD2HTR1AHTR2AHTR7HTR6 | |
| SCHEMBL9400888 | 0.72 | CA9 (0.44) | CA9CA12CA2DRD2HTR1A | |
| SCHEMBL30872949 | 0.71 | CA12 (0.71) | CA9CA12CA2ELANE |
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-5453437-A | 1,3-disubstituted pyrrolidines | BAYER AKTIENGESELLSCHAFT (DE) | 1995-09-26 | — | — | US | disclosed |
| US-5274097-A | A 1-N-heterocyclic alkylene-3-carbo or heterocyclic ring oxypyrrolidine derivative | BAYER AKTIENGESELLSCHAFT (DE) | 1993-12-28 | — | — | US | disclosed |