Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | CASP1 | P29466 | 1/20 | 0.56 |
| ▸ | CASP7 | P55210 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.53 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.49 |
| ▸ | QPCT | Q16769 | 1/20 | 0.49 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.47 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.47 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | ERN1 | O75460 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27659350 | 0.87 | NPC1 (0.65) | ALDH1A1MEN1CASP1KMT2AESR2 | |
| SCHEMBL20599410 | 0.85 | ALDH1A1 (0.58) | ALDH1A1MEN1CASP1CASP7KMT2A | |
| 2-Phenylphenol SCHEMBL27715680 | 0.81 | ALDH1A1 (0.59) | ALDH1A1MEN1CASP1CASP7KMT2A | |
| SCHEMBL28068008 | 0.81 | TGFBR1 (0.58) | ALDH1A1ESR2QPCTQPCTLPIK3R1 | |
| SCHEMBL28639353 | 0.80 | ALDH1A1 (0.47) | ALDH1A1MEN1CASP1CASP7KMT2A | |
| SCHEMBL1566756 | 0.80 | ALDH1A1 (0.56) | ALDH1A1MEN1CASP1CASP7KMT2A | |
| SCHEMBL6246626 | 0.80 | ALDH1A1 (0.47) | ALDH1A1MEN1CASP1CASP7KMT2A | |
| SCHEMBL29485612 | 0.80 | NPC1 (0.68) | ALDH1A1MEN1CASP1CASP7KMT2A | |
| SCHEMBL3726615 | 0.80 | NPC1 (0.68) | ALDH1A1MEN1CASP1CASP7KMT2A | |
| SCHEMBL29654363 | 0.78 | CCR1 (0.55) | ALDH1A1MEN1CASP1CASP7KMT2A |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105636953-B | 1,4 dibasic pyridyl derivatives and its purposes for treating the illness related to SMN shortages | 诺华股份有限公司 | 2018-01-02 | — | — | CN | claimed |
| CN-105636953-A | 1,4-disubstituted pyridazine derivatives and their use for treating smn-deficiency-related conditions | NOVARTIS AG | 2016-06-01 | — | — | CN | claimed |
| CN-105636953-B | 1,4 dibasic pyridyl derivatives and its purposes for treating the illness related to SMN shortages | 诺华股份有限公司 | 2018-01-02 | — | — | CN | disclosed |
| CN-105636953-A | 1,4-disubstituted pyridazine derivatives and their use for treating smn-deficiency-related conditions | NOVARTIS AG | 2016-06-01 | — | — | CN | disclosed |
| CN-102887891-B | N4-phenyl-quinazoline-4-sulfonamide derivatives and related compound | ARRAY BIOPHARMA INC. (US) | 2016-03-09 | — | — | CN | disclosed |
| CN-102887891-A | N4-phenyl-quinaz0line-4 -amine derivatives and related compounds | ARRAY BIOPHARMA INC | 2013-01-23 | — | — | CN | disclosed |
| CN-101906072-A | 3-phenylquinoline compounds as well as preparation method and application thereof | SHANGHAI INST MATERIA MEDICA | 2010-12-08 | — | — | CN | disclosed |
| CN-101356171-A | N4-phenyl-quinazolin-4-amine derivatives and related compounds as ERBBI type receptor tyrosine kinase inhibitors for the treatment of proliferative diseases | ARRAY BIOPHARMA INC (US) | 2009-01-28 | — | — | CN | disclosed |
| CN-1639146-A | Fused tricyclic heterocycles useful for the treatment of hyperproliferative diseases | BAYER PHARMACEUTICALS CORP (US) | 2005-07-13 | — | — | CN | disclosed |