Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | IDO1 | P14902 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27945894 | 1.00 | MAPT (0.36) | MAPTKDM4ECYP3A4IDO1TDP1 | |
| SCHEMBL987820 | 1.00 | MAPT (0.36) | MAPTKDM4ECYP3A4IDO1TDP1 | |
| SCHEMBL29700255 | 0.87 | MAOA (0.34) | MAPTKDM4ECYP3A4IDO1TDP1 | |
| SCHEMBL5732886 | 0.79 | NPC1 (0.33) | IDO1RAB9A | |
| SCHEMBL9360928 | 0.78 | SIGMAR1 (0.44) | CYP3A4MEN1KMT2ARAB9A | |
| SCHEMBL28719762 | 0.76 | ALDH1A1 (0.47) | MAPTKDM4ETDP1MEN1KMT2A | |
| SCHEMBL15227913 | 0.75 | OPRM1 (0.35) | MAPTKDM4ECYP3A4TDP1MEN1 | |
| SCHEMBL1148425 | 0.75 | HIF1A (0.34) | CA12 | |
| SCHEMBL15227868 | 0.74 | SMN1; SMN2 (0.36) | MAPTKDM4ECYP3A4TDP1MEN1 | |
| Acetic Acid SCHEMBL28722941 | 0.73 | ALDH1A1 (0.50) | TDP1MEN1KMT2ASMN1; SMN2ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117430547-A | Preparation method of single enantiomer of tetrahydrocyclopenta [ b ] indol-3-yl acetic acid and derivative thereof | 安徽艾立德制药有限公司 | 2024-01-23 | — | — | CN | claimed |
| CN-116514896-A | Synthesis method of dihydrotanshinone I | 浙江大学 | 2023-08-01 | — | — | CN | claimed |
| CN-117430547-A | Preparation method of single enantiomer of tetrahydrocyclopenta [ b ] indol-3-yl acetic acid and derivative thereof | 安徽艾立德制药有限公司 | 2024-01-23 | — | — | CN | disclosed |