Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | NOS1 | P29475 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | MAOB | P27338 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.44 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.44 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.44 |
| ▸ | GLS | O94925 | 1/20 | 0.44 |
| ▸ | PTPRC | P08575 | 1/20 | 0.44 |
| ▸ | S100A4 | P26447 | 1/20 | 0.44 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14010958 | 1.00 | MAPT (0.53) | MAPTCYP3A4NOS1LMNAALOX15 | |
| SCHEMBL28122579 | 0.82 | TSHR (0.59) | MAPTCYP3A4NOS1LMNAALOX15 | |
| SCHEMBL3829978 | 0.80 | TSHR (0.56) | MAPTCYP3A4NOS1LMNAALOX15 | |
| SCHEMBL1828850 | 0.79 | MAPT (0.49) | MAPTCYP3A4NOS1LMNAALOX15 | |
| SCHEMBL3293939 | 0.79 | MAPT (0.49) | MAPTCYP3A4NOS1LMNAALOX15 | |
| SCHEMBL28338203 | 0.78 | TSHR (0.54) | MAPTCYP3A4NOS1LMNAALOX15 | |
| SCHEMBL16307679 | 0.76 | CYP1A2 (0.48) | MAPTCYP3A4NOS1LMNAALOX15 | |
| SCHEMBL17374961 | 0.76 | PDPK1 (0.48) | MAPTCYP3A4NOS1LMNAALOX15 | |
| SCHEMBL17374976 | 0.76 | MAPT (0.46) | MAPTCYP3A4NOS1LMNAALOX15 | |
| SCHEMBL28030111 | 0.76 | HSD17B10 (0.47) | MAPTCYP3A4NOS1LMNAALOX15 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109456308-B | Heterocyclic compounds as ASK inhibitors and their use | 南京圣和药业股份有限公司 | 2022-11-29 | — | — | CN | disclosed |