Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.39 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.39 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.35 |
| ▸ | PLAU | P00749 | 1/20 | 0.35 |
| ▸ | ALDH1A3 | P47895 | 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 | |
|---|---|---|---|---|
| SCHEMBL28332550 | 0.79 | ALDH1A1 (0.44) | ALDH1A1TDP1TP53CYP3A4TSHR | |
| SCHEMBL19940003 | 0.78 | PLAU (0.42) | ALDH1A1TDP1POLBGRIN2DGRIN3B | |
| Hydrochloric Acid SCHEMBL31079711 | 0.77 | ALDH1A1 (0.42) | ALDH1A1TDP1TP53CYP3A4TSHR | |
| SCHEMBL8962727 | 0.76 | ULK1 (0.39) | ALDH1A1POLBGRIN2DGRIN3BGRIN1 | |
| SCHEMBL15828893 | 0.76 | L3MBTL1 (0.43) | ALDH1A1TDP1TP53CYP3A4TSHR | |
| SCHEMBL24105910 | 0.76 | ALDH1A1 (0.36) | ALDH1A1TDP1POLBGRIN2DGRIN3B | |
| SCHEMBL17930312 | 0.76 | ALDH1A1 (0.44) | ALDH1A1TDP1GRIN2DGRIN3BGRIN1 | |
| SCHEMBL25329078 | 0.76 | CA1 (0.46) | ALDH1A1TDP1POLBGRIN2DGRIN3B | |
| SCHEMBL8370932 | 0.76 | ALDH1A1 (0.44) | ALDH1A1POLBGRIN2DGRIN3BGRIN1 | |
| SCHEMBL16756041 | 0.76 | ALDH1A1 (0.46) | ALDH1A1TDP1CYP3A4TSHRPOLB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107629091-B | N-heterocyclic carbene ruthenium catalyst containing electron donating group and preparation method thereof | 天津斯瑞吉高新科技研究院有限公司 | 2020-05-15 | — | — | CN | disclosed |
| CN-107629091-A | A kind of N heterocycle carbine ruthenium catalysts containing electron donating group and preparation method thereof | 天津斯瑞吉高新科技研究院有限公司 | 2018-01-26 | — | — | CN | disclosed |
| CN-104844662-A | Novel N-heterocyclic carbene ruthenium catalyst containing electron donating group and preparation method thereof | TIANJIN 3&G CHEMTECH RES INST CO LTD | 2015-08-19 | — | — | CN | disclosed |
| CN-104356165-A | Novel N-heterocyclic carbene ruthenium catalyst containing electron donating group and preparation method thereof | TIANJIN 3 & G CHEMTECH RES INST CO LTD | 2015-02-18 | — | — | CN | disclosed |