Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.61 |
| ▸ | RAB9A | P51151 | 4/20 | 0.61 |
| ▸ | MAPT | P10636 | 3/20 | 0.61 |
| ▸ | GLA | P06280 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.43 |
| ▸ | ATG4B | Q9Y4P1 | 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 | |
|---|---|---|---|---|
| SCHEMBL28831662 | 0.83 | ALDH1A1 (0.61) | ALDH1A1RAB9AMAPTKDM4EHTT | |
| SCHEMBL20587799 | 0.83 | ALDH1A1 (0.61) | ALDH1A1RAB9AMAPTKDM4EHTT | |
| SCHEMBL10818920 | 0.79 | ALDH1A1 (0.46) | ALDH1A1RAB9AMAPTKDM4EHTT | |
| SCHEMBL16485946 | 0.78 | ALDH1A1 (0.55) | ALDH1A1RAB9AKDM4EHTTHPGD | |
| SCHEMBL4018977 | 0.77 | ALDH1A1 (0.72) | ALDH1A1RAB9AKDM4EHTTLMNA | |
| SCHEMBL4018980 | 0.77 | ALDH1A1 (0.72) | ALDH1A1RAB9AKDM4EHTTLMNA | |
| SCHEMBL28723992 | 0.74 | ALDH1A1 (0.47) | ALDH1A1RAB9AMAPTGLAKDM4E | |
| SCHEMBL1486309 | 0.72 | ADH1B (0.61) | ALDH1A1RAB9AMAPTGLAKDM4E | |
| SCHEMBL8856036 | 0.72 | TRPA1 (0.43) | ALDH1A1RAB9AMAPTHTTLMNA | |
| SCHEMBL27723025 | 0.72 | TRPA1 (0.43) | ALDH1A1RAB9AMAPTHTTLMNA |
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-2024026483-A2 | CDK2 INHIBITORS AND METHODS OF USING THE SAME | CEDILLA THERAPEUTICS, INC. (US) | 2024-02-01 | — | — | WO | disclosed |