Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11209901 | 0.82 | NPSR1 (0.46) | TP53TDP1MEN1KMT2AALDH1A1 | |
| SCHEMBL2022387 | 0.81 | ADRA2C (0.42) | TP53TDP1MEN1KMT2AALDH1A1 | |
| SCHEMBL9614029 | 0.78 | TP53 (0.71) | TP53NR1I2TDP1MEN1KMT2A | |
| SCHEMBL2023840 | 0.77 | HPGD (0.42) | TDP1MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL11214986 | 0.77 | TP53 (0.50) | TP53NR1I2TDP1MEN1KMT2A | |
| SCHEMBL11458462 | 0.76 | TP53 (0.46) | TP53NR1I2TDP1MEN1KMT2A | |
| SCHEMBL9214096 | 0.76 | TP53 (0.59) | TP53NR1I2TDP1MEN1KMT2A | |
| SCHEMBL2022652 | 0.72 | TSHR (0.43) | MEN1KMT2AALDH1A1HPGDADRA2C | |
| SCHEMBL27521389 | 0.71 | TP53 (0.50) | TP53MEN1KMT2AALDH1A1CYP3A4 | |
| SCHEMBL131683 | 0.71 | TP53 (0.66) | TP53NR1I2TDP1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0013361-B1 | SUBSTITUTED N-HALOGENOMETHYL ANILIDES, PROCESS FOR THEIR PREPARATION AND USE | BASF Aktiengesellschaft (DE) | 1981-09-16 | — | — | EP | claimed |
| US-4340739-A | CHEMICAL INTERMEDIATES IN THE PRODUCTION OF N-AZOLYLMETHYL-COMPOUNDS | BASF AKTIENGESELLSCHAFT (DE) | 1982-07-20 | — | — | US | disclosed |