Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | HPGDS | O60760 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5234936 | 0.85 | CA2 (0.53) | CA2CHRNA7LMNARECQLALDH1A1 | |
| SCHEMBL5234682 | 0.83 | CHRNA7 (0.41) | CA2CHRNA7ALDH1A1KMT2AHTR3A | |
| SCHEMBL5237282 | 0.83 | HDAC3 (0.55) | CHRNA7ALDH1A1HTR3AHSD17B10KDM4E | |
| SCHEMBL5200826 | 0.83 | CHRNA1 (0.40) | CA2RECQLALDH1A1HSD17B10KDM4E | |
| SCHEMBL5230188 | 0.79 | HDAC3 (0.59) | CHRNA7ALDH1A1KMT2AHTR3AKDM4E | |
| SCHEMBL5232413 | 0.79 | CHRNA7 (0.42) | CA2CHRNA7ALDH1A1HTR3AHSD17B10 | |
| SCHEMBL9409696 | 0.78 | KDM4E (0.48) | CA2LMNAALDH1A1KMT2AHSD17B10 | |
| SCHEMBL5231955 | 0.78 | MEN1 (0.51) | LMNAALDH1A1KMT2AKDM4ERAB9A | |
| SCHEMBL2895989 | 0.77 | ALDH1A1 (0.55) | CA2CHRNA7LMNARECQLALDH1A1 | |
| SCHEMBL5198179 | 0.77 | HDAC3 (0.49) | CA2LMNADYRK1AHDAC3HDAC4 |
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-1461335-B1 | 2-HETEROARYLCARBOXYLIC ACID AMIDES | BAYER HEALTHCARE AG (DE) | 2007-02-28 | — | — | EP | disclosed |
| EP-1461335-A1 | 2-HETEROARYLCARBOXYLIC ACID AMIDES | Bayer HealthCare AG (DE) | 2004-09-29 | — | — | EP | disclosed |
| WO-2003055878-A1 | 2-HETEROARYLCARBOXYLIC ACID AMIDES | BAYER HEALTHCARE AG (DE) | 2003-07-10 | — | — | WO | disclosed |