Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 2/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | CDK4 | P11802 | 1/20 | 0.39 |
| ▸ | CCND1 | P24385 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.36 |
| ▸ | KRAS | P01116 | 2/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | OXER1 | Q8TDS5 | 1/20 | 0.34 |
| ▸ | KMO | O15229 | 1/20 | 0.33 |
| ▸ | ACLY | P53396 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29924782 | 1.00 | HTR2C (0.49) | HTR2CHTR2ACDK4CCND1SLC6A2 | |
| SCHEMBL29925168 | 0.84 | HTR2C (0.48) | HTR2CHTR2ACDK4CCND1DGAT1 | |
| SCHEMBL28840671 | 0.84 | HTR2C (0.48) | HTR2CHTR2ACDK4CCND1DGAT1 | |
| SCHEMBL29924561 | 0.83 | HTR2C (0.51) | HTR2CHTR2ASLC6A2PRMT5 | |
| SCHEMBL1467091 | 0.83 | HTR2A (0.49) | HTR2CHTR2ASLC6A2DGAT1PRMT5 | |
| SCHEMBL29924680 | 0.83 | DGAT1 (0.36) | HTR2CHTR2ADGAT1KRASNPC1 | |
| SCHEMBL4493915 | 0.83 | HTR2C (0.49) | HTR2CHTR2ACDK4CCND1DGAT1 | |
| SCHEMBL28840999 | 0.83 | DGAT1 (0.36) | HTR2CHTR2ADGAT1KRASNPC1 | |
| SCHEMBL28841058 | 0.83 | HTR2C (0.51) | HTR2CHTR2ASLC6A2PRMT5 | |
| SCHEMBL24805178 | 0.81 | DGAT1 (0.39) | HTR2CHTR2ADGAT1PTPN1NPC1 |
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-115028655-B | 2-trifluoromethyl-3-iodo-indole compound and preparation method thereof | 上海大学 | 2024-01-16 | — | — | CN | claimed |
| CN-115028655-A | 2-trifluoromethyl-3-iodine-indole compound and preparation method thereof | 上海大学 | 2022-09-09 | — | — | CN | claimed |
| CN-115028655-B | 2-trifluoromethyl-3-iodo-indole compound and preparation method thereof | 上海大学 | 2024-01-16 | — | — | CN | disclosed |
| CN-115028655-A | 2-trifluoromethyl-3-iodine-indole compound and preparation method thereof | 上海大学 | 2022-09-09 | — | — | CN | disclosed |