Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | YTHDC1 | Q96MU7 | 3/20 | 0.69 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.67 |
| ▸ | NPC1 | O15118 | 1/20 | 0.65 |
| ▸ | RAB9A | P51151 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.65 |
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.61 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | APEX1 | P27695 | 1/20 | 0.61 |
| ▸ | PI4KA | P42356 | 1/20 | 0.61 |
| ▸ | BLM | P54132 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.61 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.61 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.61 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.61 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL20322942 | 1.00 | YTHDC1 (0.69) | YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9885102 | 0.86 | NPC1 (0.71) | YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL31569297 | 0.84 | CYP2C19 (0.74) | YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4572213 | 0.84 | CYP2C19 (0.74) | YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL18040445 | 0.82 | NPC1 (0.72) | YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL12894740 | 0.82 | CYP2C19 (0.57) | YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9884054 | 0.82 | CYP2C19 (0.57) | YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL19049986 | 0.81 | YTHDC1 (1.00) | YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL17847679 | 0.81 | NPC1 (0.64) | YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL18040443 | 0.81 | CYP2C19 (0.56) | YTHDC1CYP2C19NPC1RAB9ASMN1; SMN2 |
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-4291176-A1 | CDK INHIBITORS AND METHODS OF USE THEREOF | Relay Therapeutics, Inc. (US) | 2023-12-20 | — | — | EP | disclosed |