Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | KDM5A | P29375 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | JAK2 | O60674 | 2/20 | 0.32 |
| ▸ | JAK1 | P23458 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL508784 | 0.82 | BTK (0.49) | EPHX1KMT2A | |
| SCHEMBL471719 | 0.82 | BTK (0.49) | EPHX1KMT2A | |
| SCHEMBL9987270 | 0.82 | NFKB1 (0.42) | MAPTTSHRSMN1; SMN2LMNATP53 | |
| SCHEMBL471720 | 0.82 | BTK (0.49) | EPHX1KMT2A | |
| SCHEMBL9978384 | 0.82 | NFKB1 (0.42) | MAPTTSHRSMN1; SMN2LMNATP53 | |
| SCHEMBL11161552 | 0.80 | ATM (0.42) | MAPTTSHRSMN1; SMN2LMNATP53 | |
| SCHEMBL14789368 | 0.80 | ATM (0.42) | MAPTTSHRSMN1; SMN2LMNATP53 | |
| SCHEMBL468211 | 0.78 | ALDH1A1 (0.38) | MAPTTSHRSMN1; SMN2LMNATP53 | |
| SCHEMBL1562008 | 0.78 | EPHX1 (0.44) | MAPTTSHRSMN1; SMN2EPHX1ALDH1A1 | |
| SCHEMBL825500 | 0.78 | ALDH1A1 (0.38) | MAPTTSHRSMN1; SMN2LMNATP53 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103492370-B | Substituted diaminocarboxamides and diaminocarbonitrile pyrimidines, compositions thereof, and methods of treatment therewith | 西格诺药品有限公司 | 2016-10-26 | — | — | CN | disclosed |