Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.63 |
| ▸ | NCK1 | P16333 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | ACHE | P22303 | 5/20 | 0.50 |
| ▸ | BCHE | P06276 | 4/20 | 0.50 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.50 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | ELANE | P08246 | 1/20 | 0.44 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.44 |
| ▸ | NOS3 | P29474 | 1/20 | 0.44 |
| ▸ | NOS1 | P29475 | 1/20 | 0.44 |
| ▸ | NOS2 | P35228 | 1/20 | 0.44 |
| ▸ | RAD52 | P43351 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL5456804 | 0.84 | BACE1 (0.55) | BACE1NCK1ACHEBCHEGRIN1 | |
| SCHEMBL11399020 | 0.81 | BACE1 (0.52) | BACE1NCK1MEN1KMT2AACHE | |
| SCHEMBL17827033 | 0.81 | LMNA (0.68) | BACE1NCK1ACHEBCHEGRIN1 | |
| SCHEMBL3531515 | 0.79 | LMNA (0.66) | MEN1KMT2AACHEBCHEGRIN1 | |
| SCHEMBL11130296 | 0.78 | BACE1 (0.56) | BACE1MEN1KMT2ALMNAGAA | |
| SCHEMBL9381975 | 0.78 | BACE1 (0.49) | BACE1NCK1MEN1KMT2AACHE | |
| SCHEMBL3094768 | 0.78 | BACE1 (1.00) | BACE1ACHELMNAGAAPRMT5 | |
| SCHEMBL23757101 | 0.77 | BACE1 (0.54) | BACE1MEN1KMT2AGAAHTT | |
| SCHEMBL2538787 | 0.76 | KDM4E (0.66) | MEN1KMT2AACHEBCHEGRIN1 | |
| SCHEMBL934670 | 0.76 | KMT2A (0.56) | MEN1KMT2AACHEBCHEGRIN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5112837-A | Inhibitors of thymidylate synthetase enzyme | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-05-12 | — | — | US | disclosed |
| EP-0318225-A2 | 6-Aryl aminomethyl quinoline derivatives and their use as anti-tumour agents | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1989-05-31 | — | — | EP | disclosed |