Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.58 |
| ▸ | CDC7 | O00311 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | CES2 | O00748 | 1/20 | 0.49 |
| ▸ | CES1 | P23141 | 1/20 | 0.49 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.47 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.47 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7256623 | 0.84 | BCAT2 (0.57) | TSHRCDC7KMT2AALDH1A1MAPT | |
| SCHEMBL27922031 | 0.83 | PARP1 (0.57) | TSHRCDC7KMT2AALDH1A1MAPT | |
| SCHEMBL27710643 | 0.82 | TSHR (0.45) | TSHRCDC7KMT2AALDH1A1MAPT | |
| SCHEMBL29032715 | 0.81 | IKBKB (0.64) | TSHRCDC7KMT2AALDH1A1MAPT | |
| SCHEMBL8337611 | 0.80 | TSHR (0.54) | TSHRCDC7KMT2AALDH1A1MAPT | |
| SCHEMBL27993567 | 0.80 | KMT2A (0.60) | TSHRCDC7KMT2AALDH1A1MAPT | |
| SCHEMBL9186952 | 0.79 | ALDH1A1 (0.55) | TSHRKMT2AALDH1A1MAPTMEN1 | |
| SCHEMBL28245589 | 0.79 | TSHR (0.81) | TSHRKMT2AALDH1A1MAPTMEN1 | |
| SCHEMBL27889371 | 0.77 | TSHR (0.68) | TSHRKMT2AALDH1A1MAPTMEN1 | |
| SCHEMBL11889464 | 0.77 | TDP1 (0.63) | TSHRCDC7KMT2AALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-103373938-B | A kind of 4-oxyethyl group-1,3-phenyl-diformyl aminated compounds and Synthesis and applications thereof | TIANJIN UNIVERSITY OF TECHNOLOGY (CN) | 2016-03-30 | — | — | CN | disclosed |
| CN-103373938-A | 4-ethoxy-1,3-phenylenedimethylene amide compounds as well as preparation methods and applications thereof | UNIV TIANJIN TECHNOLOGY | 2013-10-30 | — | — | CN | disclosed |