Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MAOB | P27338 | 3/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.45 |
| ▸ | BCHE | P06276 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KDM1A | O60341 | 2/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | FOXM1 | Q08050 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL695510 | 0.89 | ALDH1A1 (0.62) | ALDH1A1MAOBKDM4EKDM1A | |
| SCHEMBL2807484 | 0.83 | KMT2A (0.47) | ALDH1A1MAOBHRH3BCHECYP2C9 | |
| SCHEMBL15012151 | 0.80 | MEN1 (0.42) | ALDH1A1MAOBBCHEKMT2AKDM4E | |
| SCHEMBL5555860 | 0.77 | BCHE (0.65) | BCHEKMT2AKDM4ESMN1; SMN2MEN1 | |
| SCHEMBL15012179 | 0.76 | KDM4E (0.48) | ALDH1A1MAOBBCHEKMT2AKDM4E | |
| SCHEMBL8265518 | 0.75 | CNR1 (0.55) | ALDH1A1KDM4E | |
| SCHEMBL5555203 | 0.75 | HRH3 (0.58) | ALDH1A1HRH3CYP2C9KMT2AKDM4E | |
| Ammonia Solution, Strong SCHEMBL9637696 | 0.75 | ALDH1A1 (0.59) | ALDH1A1CYP2C9KDM4EKDM1A | |
| SCHEMBL9637698 | 0.75 | ALDH1A1 (0.56) | ALDH1A1HRH3CYP2C9KDM1A | |
| SCHEMBL89233 | 0.75 | ALDH1A1 (0.66) | ALDH1A1HRH3KMT2AKDM4EMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013084241-A1 | COMPOUNDS AS INHIBITORS OF RENIN | CADILA HEALTHCARE LIMITED (IN) | 2013-06-13 | — | — | WO | disclosed |