Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.60 |
| ▸ | NPC1 | O15118 | 3/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | LTA4H | P09960 | 1/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA7 | P43166 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | SCN1A | P35498 | 1/20 | 0.50 |
| ▸ | HTR2B | P41595 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL12260624 | 0.86 | ESR1 (0.59) | LTA4HHRH3 | |
| SCHEMBL14047042 | 0.84 | ALDH1A1 (0.54) | ALDH1A1KDM4ENPC1RAB9AMEN1 | |
| SCHEMBL1911879 | 0.84 | NPC1 (0.69) | ALDH1A1KDM4ENPC1RAB9AMEN1 | |
| SCHEMBL538618 | 0.83 | ALDH1A1 (0.60) | ALDH1A1KDM4ENPC1RAB9AMEN1 | |
| SCHEMBL1962706 | 0.83 | ALDH1A1 (0.60) | ALDH1A1KDM4ENPC1RAB9AMEN1 | |
| SCHEMBL30402431 | 0.83 | ALDH1A1 (0.60) | ALDH1A1KDM4ENPC1RAB9AMEN1 | |
| SCHEMBL2816112 | 0.81 | ALDH1A1 (0.58) | ALDH1A1KDM4ENPC1RAB9AMEN1 | |
| SCHEMBL20522213 | 0.81 | KDM4E (0.60) | ALDH1A1KDM4ENPC1RAB9AMEN1 | |
| SCHEMBL2077596 | 0.80 | KDM4E (0.56) | ALDH1A1KDM4ENPC1RAB9AMEN1 | |
| SCHEMBL14084486 | 0.79 | NPC1 (0.66) | ALDH1A1KDM4ENPC1RAB9ALTA4H |
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-1836169-B9 | COMPOSITIONS AND METHODS OF TREATING CELL PROLIFERATION DISORDERS | KINEX PHARMACEUTICALS LLC (US) | 2012-07-04 | — | — | EP | disclosed |
| EP-1836169-B1 | COMPOSITIONS AND METHODS OF TREATING CELL PROLIFERATION DISORDERS | KINEX PHARMACEUTICALS LLC (US) | 2012-02-08 | — | — | EP | disclosed |