Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.42 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8576110 | 0.83 | TSHR (0.58) | TSHRCYP3A4ALDH1A1MAPTNCEH1 | |
| SCHEMBL7057106 | 0.83 | TSHR (0.54) | TSHRCYP3A4ALDH1A1MAPTNCEH1 | |
| SCHEMBL9638921 | 0.81 | TSHR (0.53) | TSHRCYP3A4ALDH1A1MAPTNCEH1 | |
| SCHEMBL12363753 | 0.80 | TSHR (0.64) | TSHRCYP3A4ALDH1A1MAPTHPGD | |
| SCHEMBL2888432 | 0.80 | TSHR (0.59) | TSHRCYP3A4ALDH1A1MAPTNCEH1 | |
| SCHEMBL29844402 | 0.79 | TSHR (0.57) | TSHRCYP3A4ALDH1A1MAPTHTT | |
| SCHEMBL11350432 | 0.79 | TSHR (0.57) | TSHRCYP3A4ALDH1A1MAPTHTT | |
| SCHEMBL7061346 | 0.78 | MAPT (0.41) | TSHRCYP3A4ALDH1A1MAPTHPGD | |
| SCHEMBL31146864 | 0.78 | TSHR (0.53) | TSHRCYP3A4ALDH1A1MAPTHPGD | |
| SCHEMBL28965419 | 0.78 | TSHR (0.53) | TSHRCYP3A4ALDH1A1MAPTHPGD |
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-112047871-B | Preparation method of indole compound | 南京大学 | 2022-06-21 | — | — | CN | disclosed |
| CN-112047871-A | Preparation method of indole compound | 南京大学 | 2020-12-08 | — | — | CN | disclosed |