Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.48 |
| ▸ | CLK1 | P49759 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.46 |
| ▸ | MEN1 | O00255 | 7/20 | 0.46 |
| ▸ | MAPT | P10636 | 6/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL1704253 | 0.86 | CDK2 (0.53) | ALDH1A1CLK1KMT2AMEN1MAPT | |
| SCHEMBL12841836 | 0.80 | CDK2 (0.55) | ALDH1A1CLK1NPC1TSHRRAB9A | |
| SCHEMBL2073904 | 0.79 | CDK2 (0.57) | ALDH1A1CLK1KMT2AMEN1MAPT | |
| SCHEMBL5245918 | 0.75 | GAA (0.46) | ALDH1A1KMT2ASMN1; SMN2GAAKDM4E | |
| SCHEMBL27624139 | 0.75 | CDK2 (0.52) | ALDH1A1CLK1NPC1TSHRRAB9A | |
| SCHEMBL2074524 | 0.71 | CDK2 (0.57) | CLK1TNIK | |
| SCHEMBL2075857 | 0.70 | CDK2 (0.56) | CLK1GAATNIK | |
| SCHEMBL2075970 | 0.69 | MEN1 (0.53) | ALDH1A1KMT2AMEN1MAPTSMN1; SMN2 | |
| SCHEMBL14851611 | 0.67 | PIK3CG (0.72) | ALDH1A1CLK1NPC1TSHRRAB9A | |
| SCHEMBL924953 | 0.67 | PIK3CA (0.56) | ALDH1A1CLK1NPC1TSHRRAB9A |
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-1864983-A1 | PYRIMIDINE COMPOUNDS AS CYCLIN-DEPENDENT KINASE INHIBITORS | Cyclacel Limited (GB) | 2007-12-12 | — | — | EP | claimed |