Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 2/20 | 0.37 |
| ▸ | HTR2B | P41595 | 2/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13700993 | 0.79 | ACHE (0.52) | KDM4EMEN1KMT2AUSP2SMN1; SMN2 | |
| SCHEMBL16885084 | 0.79 | LMNA (0.45) | KDM4EIDO1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL4803339 | 0.78 | ALDH1A1 (0.42) | KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL20563209 | 0.77 | HTR2C (0.38) | KDM4EIDO1NFE2L2MEN1KMT2A | |
| SCHEMBL8444448 | 0.76 | MTNR1A (0.51) | KMT2AL3MBTL1ALDH1A1PKMTDP1 | |
| SCHEMBL21371993 | 0.76 | AR (0.52) | HTR2AHTR2CHTR2BSLC6A2SLC6A4 | |
| SCHEMBL31682767 | 0.75 | NPC1 (0.49) | KDM4EMEN1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL5882272 | 0.74 | ALDH1A1 (0.58) | MEN1KMT2ASMN1; SMN2L3MBTL1ALDH1A1 | |
| SCHEMBL779536 | 0.72 | DDR1 (0.38) | IDO1HTR2AHTR2CHTR2BALDH1A1 | |
| SCHEMBL321697 | 0.72 | KDM4E (0.53) | KDM4ENFE2L2MEN1KMT2AUSP2 |
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-2501236-B1 | N-[2-fluoro-3-(4-amino-7H-pyrrolo[2,3-d]pyrimidine-5-carbonyl)-phenyl]-4-benzenesulfonamide derivatives as Raf protein kinase modulators for the treatment of cancer | PLEXXIKON INC (US) | 2017-03-29 | — | — | EP | disclosed |