Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.52 |
| ▸ | IKBKB | O14920 | 1/20 | 0.47 |
| ▸ | HSD17B2 | P37059 | 12/20 | 0.43 |
| ▸ | HSD17B1 | P14061 | 11/20 | 0.43 |
| ▸ | HPGDS | O60760 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27816545 | 0.88 | HPGDS (0.56) | HSD17B2HSD17B1HPGDSRAB9AKDM4E | |
| SCHEMBL5605082 | 0.77 | HSD17B1 (0.60) | EPHX2IKBKBHSD17B2HSD17B1HPGDS | |
| SCHEMBL2690201 | 0.74 | IKBKB (0.68) | EPHX2IKBKBHPGDSRAB9AKDM4E | |
| SCHEMBL1784584 | 0.73 | HPGDS (0.73) | EPHX2IKBKBHSD17B2HSD17B1HPGDS | |
| SCHEMBL6612574 | 0.73 | HPGDS (0.60) | EPHX2IKBKBHSD17B2HSD17B1HPGDS | |
| SCHEMBL28911367 | 0.73 | PARP1 (0.49) | RAB9AKDM4ENPC1ALDH1A1MEN1 | |
| SCHEMBL29922717 | 0.72 | EPHX2 (0.58) | EPHX2IKBKBHSD17B2HSD17B1HPGDS | |
| SCHEMBL28541614 | 0.72 | EPHX2 (0.58) | EPHX2IKBKBHSD17B2HSD17B1HPGDS | |
| SCHEMBL27565420 | 0.72 | ESRRG (0.59) | EPHX2IKBKBHSD17B2HSD17B1HPGDS | |
| SCHEMBL27565581 | 0.72 | IKBKB (0.71) | EPHX2IKBKBHSD17B2HSD17B1HPGDS |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102149703-A | Anti-cancer drugs and uses relating thereto for metastatic malignant melanoma and other cancers | LAILA NUTRACEUTICALS | 2011-08-10 | — | — | CN | claimed |
| CN-102149703-B | Anti-cancer drugs and uses relating thereto for metastatic malignant melanoma and other cancers | LAILA NUTRACEUTICALS | 2014-09-10 | — | — | CN | disclosed |
| CN-102149703-A | Anti-cancer drugs and uses relating thereto for metastatic malignant melanoma and other cancers | LAILA NUTRACEUTICALS | 2011-08-10 | — | — | CN | disclosed |