Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | NAAA | Q02083 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | ASAH1 | Q13510 | 2/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.43 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.43 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.43 |
| ▸ | ACER2 | Q5QJU3 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CTSG | P08311 | 1/20 | 0.40 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.40 |
| ▸ | CMA1 | P23946 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 2/20 | 0.40 |
| ▸ | MMP9 | P14780 | 2/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.40 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10660782 | 1.00 | ALDH1A1 (0.48) | ALDH1A1NAAANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28050105 | 1.00 | ALDH1A1 (0.48) | ALDH1A1NAAANPC1RAB9ASMN1; SMN2 | |
| Oxalic Acid SCHEMBL28200208 | 0.98 | ALDH1A1 (0.47) | ALDH1A1NAAANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL10661014 | 0.94 | POLB (0.47) | ALDH1A1NAAAPOLBCNR2 | |
| SCHEMBL1836778 | 0.88 | ALDH1A1 (0.50) | ALDH1A1NAAANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1836595 | 0.88 | ALDH1A1 (0.50) | ALDH1A1NAAANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1840792 | 0.88 | ALDH1A1 (0.50) | ALDH1A1NAAANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1836596 | 0.88 | ALDH1A1 (0.50) | ALDH1A1NAAANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1841905 | 0.88 | ALDH1A1 (0.50) | ALDH1A1NAAANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1836019 | 0.88 | ALDH1A1 (0.50) | ALDH1A1NAAANPC1RAB9ASMN1; SMN2 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102574857-B | Heterocyclic compounds as jak receptor and protein tyrosine kinase inhibitors | LEO PHARMA AS | 2015-06-10 | — | — | CN | claimed |
| CN-110300756-A | Preparation method of 7H-pyrrolo [2,3-d ] pyrimidine derivative and synthetic intermediate thereof | 日本烟草产业株式会社 | 2019-10-01 | — | — | CN | disclosed |
| CN-110099910-A | Preparation method of 7H-pyrrolo [2,3-d ] pyrimidine derivative and eutectic crystal thereof | 日本烟草产业株式会社 | 2019-08-06 | — | — | CN | disclosed |
| CN-105209470-B | For treating and preventing the heteroaryl dihydro-pyrimidin of 6 hepatitis b virus infected bridgings | 豪夫迈·罗氏有限公司 | 2018-02-06 | — | — | CN | disclosed |
| CN-104011054-B | As the thieno of potassium channel inhibitors and Furanopyrimidines class and pyridines | 森申有限公司 | 2016-08-24 | — | — | CN | disclosed |
| CN-105209470-A | 6-bridged heteroaryldihydropyrimidines for the treatment and prophylaxis of hepatitis b virus infection | HOFFMANN LA ROCHE | 2015-12-30 | — | — | CN | disclosed |
| CN-102574857-B | Heterocyclic compounds as jak receptor and protein tyrosine kinase inhibitors | LEO PHARMA AS | 2015-06-10 | — | — | CN | disclosed |