Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALM1 | P0DP23 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TYMP | P19971 | 1/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5247984 | 0.85 | CALM1 (0.52) | CALM1ALDH1A1TYMPAKR1B1TAAR1 | |
| SCHEMBL2847180 | 0.80 | TAAR1 (0.41) | ALDH1A1TAAR1LMNAKDM4ETSHR | |
| SCHEMBL7669757 | 0.78 | CALM1 (0.44) | CALM1ALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL253444 | 0.76 | IDH1 (0.45) | CALM1TYMPAKR1B1TAAR1LMNA | |
| SCHEMBL21971599 | 0.76 | LMNA (0.55) | ALDH1A1TAAR1LMNAMEN1KMT2A | |
| SCHEMBL7866821 | 0.76 | TSHR (0.48) | CALM1ALDH1A1TYMPAKR1B1TAAR1 | |
| SCHEMBL30064859 | 0.76 | ALDH1A1 (0.48) | CALM1ALDH1A1AKR1B1LMNAMEN1 | |
| SCHEMBL560292 | 0.76 | ALDH1A1 (0.48) | CALM1ALDH1A1AKR1B1LMNAMEN1 | |
| SCHEMBL7632931 | 0.76 | BCL2 (0.45) | CALM1LMNAMEN1KMT2A | |
| SCHEMBL27286175 | 0.76 | ALDH1A1 (0.48) | CALM1ALDH1A1 |
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-105111148-A | 2-[(N-para-chlorophenyl)-3-pyrazole oxymethyl]nitrobenzene and preparation method therefor and application thereof | ANHUI COSTAR BIO CHEMICAL CO LTD | 2015-12-02 | — | — | CN | disclosed |