Known targets — ChEMBL curated mechanism
CACNA1CCACNA1DCACNA1FCACNA1SDPP4HTR1BHTR1D
The experimentally established mechanism targets of Atrolactamide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CA4 | P22748 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | KCNN4 | O15554 | 4/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | TNF | P01375 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Atrolactamide SCHEMBL78236 | 0.86 | MAPT (0.65) | MAPTKMT2ATDP1CYP2C19TSHR | |
| Atrolactamide SCHEMBL28201551 | 0.84 | MAPT (0.55) | MAPTKMT2ATDP1CYP2C19TSHR | |
| Tert-Butylbenzene SCHEMBL28679087 | 0.80 | CA2 (0.61) | CA2CA4MAPTKMT2ATDP1 | |
| Atrolactamide SCHEMBL28842804 | 0.79 | MAPT (0.57) | MAPTKMT2ACYP2C19TSHRCYP1A2 | |
| Atrolactamide SCHEMBL6903234 | 0.79 | MAPT (0.49) | MAPTKMT2ATDP1CYP2C19TSHR | |
| Benzoic Acid SCHEMBL18526893 | 0.78 | CA2 (0.84) | CA2CA4MAPTKMT2ATDP1 | |
| Potassium Ion SCHEMBL11440871 | 0.76 | KMT2A (0.47) | CA2CA4MAPTKMT2ACYP2C19 | |
| Benzoic Acid SCHEMBL28292904 | 0.76 | CA2 (0.73) | CA2CA4TDP1TSHRHSD17B10 | |
| Benzoic Acid SCHEMBL188041 | 0.75 | CA2 (0.89) | CA2CA4MAPTKMT2ATDP1 | |
| Benzoic Acid SCHEMBL16121 | 0.75 | CA2 (0.89) | CA2CA4MAPTKMT2ATDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110420140-B | Pouch removing cream with long-acting pouch removing effect and preparation method thereof | 广州艾蓓生物科技有限公司 | 2022-09-27 | — | — | CN | claimed |
| CN-110420140-B | Pouch removing cream with long-acting pouch removing effect and preparation method thereof | 广州艾蓓生物科技有限公司 | 2022-09-27 | — | — | CN | disclosed |