Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.52 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.52 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.48 |
| ▸ | HTR6 | P50406 | 1/20 | 0.47 |
| ▸ | RET | P07949 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.44 |
| ▸ | PRCP | P42785 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11671198 | 0.77 | SRD5A1 (0.55) | IDO1PDPK1CYP11B2RETHTR2A | |
| SCHEMBL10633202 | 0.75 | IDO1 (0.52) | IDO1PDPK1CYP11B2HTR6RET | |
| Magnesium SCHEMBL31510119 | 0.75 | SRD5A1 (0.53) | IDO1PDPK1CYP11B2RETHTR2A | |
| SCHEMBL9776721 | 0.73 | IDO1 (0.50) | IDO1PDPK1CYP11B2HTR6RET | |
| SCHEMBL1973082 | 0.73 | IDO1 (0.50) | IDO1PDPK1CYP11B2HTR6RET | |
| SCHEMBL23343810 | 0.73 | IDO1 (0.50) | IDO1PDPK1CYP11B2HTR6RET | |
| SCHEMBL14647558 | 0.73 | IDO1 (0.50) | IDO1PDPK1CYP11B2RETHTR2A | |
| SCHEMBL21114381 | 0.73 | IDO1 (0.50) | IDO1PDPK1CYP11B2RETHTR2A | |
| SCHEMBL864856 | 0.73 | IDO1 (0.50) | IDO1PDPK1CYP11B2HTR6RET | |
| SCHEMBL3418678 | 0.73 | IDO1 (0.50) | IDO1PDPK1CYP11B2RETHTR2A |
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-118184712-A | Method for interfering with continuous movement of carbon atoms in organic molecules | 河南省科学院化学研究所有限公司 | 2024-06-14 | — | — | CN | disclosed |