Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MLNR | O43193 | 8/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | CCR5 | P51681 | 1/20 | 0.38 |
| ▸ | UBE2M | P61081 | 2/20 | 0.36 |
| ▸ | DCUN1D1 | Q96GG9 | 2/20 | 0.36 |
| ▸ | TACR2 | P21452 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3667635 | 0.90 | KMT2A (0.40) | ALDH1A1POLBKMT2AKDM4EMLNR | |
| SCHEMBL4786234 | 0.78 | DPP7 (0.39) | ALDH1A1CYP3A4CYP2D6UBE2MDCUN1D1 | |
| SCHEMBL4731396 | 0.76 | KCNH2 (0.40) | ALDH1A1CYP3A4KCNH2 | |
| SCHEMBL3670283 | 0.74 | SIGMAR1 (0.39) | ALDH1A1POLBKMT2ATACR2TACR1 | |
| SCHEMBL3808885 | 0.73 | DPP7 (0.41) | ALDH1A1KDM4ETACR1MAPT | |
| SCHEMBL13079560 | 0.73 | KDM4E (0.48) | ALDH1A1POLBKMT2AKDM4EMLNR | |
| SCHEMBL4131412 | 0.72 | KDM4E (0.60) | ALDH1A1POLBKMT2AKDM4EMLNR | |
| SCHEMBL3727160 | 0.72 | RORC (0.38) | ALDH1A1KCNH2CCR5 | |
| SCHEMBL6402638 | 0.71 | EPHX2 (0.52) | ALDH1A1KMT2ACYP3A4CYP2D6KCNH2 | |
| SCHEMBL4736472 | 0.71 | ALDH1A1 (0.45) | ALDH1A1KMT2AKDM4ETACR1SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1997805-A1 | Compounds with antiparasitic activity, applications thereof to the treatment of infectious diseases caused by apicomplexans | Commissariat à l'Energie Atomique (FR) | 2008-12-03 | — | — | EP | claimed |