Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 2/20 | 0.51 |
| ▸ | BTK | Q06187 | 4/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | DRD4 | P21917 | 1/20 | 0.48 |
| ▸ | XIAP | P98170 | 1/20 | 0.48 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.48 |
| ▸ | JAK3 | P52333 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.43 |
| ▸ | CCNK | O75909 | 1/20 | 0.43 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL26032620 | 0.91 | ALDH1A1 (0.51) | NOTUMBTKSMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL16123336 | 0.82 | BRD4 (0.51) | NOTUMBTKJAK3ALDH1A1EGFR | |
| SCHEMBL29782485 | 0.82 | XIAP (0.47) | NOTUMBTKXIAPBIRC2ALDH1A1 | |
| SCHEMBL17699740 | 0.82 | XIAP (0.47) | NOTUMBTKXIAPBIRC2ALDH1A1 | |
| SCHEMBL429841 | 0.81 | NOTUM (0.76) | NOTUMDRD2DRD4XIAPBIRC2 | |
| SCHEMBL31561911 | 0.81 | BTK (0.49) | NOTUMBTKJAK3HPGDALDH1A1 | |
| SCHEMBL30697880 | 0.80 | MAP2K7 (0.50) | BTKJAK3EGFRFGFR4 | |
| SCHEMBL27341151 | 0.80 | MAP2K7 (0.50) | BTKJAK3EGFRFGFR4 | |
| SCHEMBL26691238 | 0.80 | NOTUM (0.55) | NOTUMDRD2DRD4XIAPBIRC2 | |
| SCHEMBL31562048 | 0.79 | XIAP (0.53) | NOTUMBTKXIAPBIRC2JAK3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018098473-A1 | REAGENTS AND METHODS FOR ANALYSIS OF PROTEINS AND METABOLITES TARGETED BY COVALENT PROBES | DANA-FARBER CANCER INSTITUTE, INC. (US) | 2018-05-31 | — | — | WO | disclosed |