Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.49 |
| ▸ | NPC1 | O15118 | 5/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | JAK2 | O60674 | 2/20 | 0.43 |
| ▸ | JAK3 | P52333 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL309808 | 0.85 | ALDH1A1 (0.54) | RAB9ANPC1HPGDTP53ALDH1A1 | |
| Ethyl Picolinate SCHEMBL6739951 | 0.77 | ALDH1A1 (0.53) | RAB9ANPC1HPGDTP53ALDH1A1 | |
| 2-Aminopyridine SCHEMBL27511657 | 0.76 | NOS2 (0.53) | RAB9ANPC1HPGDTP53ALDH1A1 | |
| Ethyl Isonicotinate SCHEMBL6738626 | 0.75 | NPC1 (0.50) | RAB9ANPC1HPGDTP53ALDH1A1 | |
| SCHEMBL181049 | 0.73 | ALDH1A1 (0.60) | RAB9ANPC1HPGDTP53ALDH1A1 | |
| SCHEMBL2701264 | 0.72 | ALDH1A1 (0.55) | RAB9ANPC1HPGDTP53ALDH1A1 | |
| SCHEMBL3261638 | 0.71 | TSHR (0.52) | ALDH1A1HSD17B10KDM4ETSHRMAPT | |
| SCHEMBL5793588 | 0.71 | KMT2A (0.49) | RAB9ANPC1ALDH1A1KDM4EMAPT | |
| SCHEMBL2921221 | 0.70 | JAK2 (0.57) | RAB9ANPC1HPGDTP53ALDH1A1 | |
| SCHEMBL3080180 | 0.69 | L3MBTL1 (0.53) | RAB9ANPC1HPGDKDM4ETSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1339702-A1 | 5-AMIDE SUBSTITUTED DIARYLAMINES AS MEK INHIBITORS | WARNER-LAMBERT COMPANY (US) | 2003-09-03 | — | — | EP | disclosed |
| WO-2001068619-A1 | 5-AMIDE SUBSTITUTED DIARYLAMINES AS MEX INHIBITORS | WARNER-LAMBERT COMPANY (US) | 2001-09-20 | — | — | WO | disclosed |