Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 5/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 3/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.34 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | SRC | P12931 | 1/20 | 0.31 |
| ▸ | CCR9 | P51686 | 1/20 | 0.31 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28360382 | 0.90 | LMNA (0.43) | MAPTLMNATP53RXFP1THRB | |
| SCHEMBL28360338 | 0.85 | MCL1 (0.46) | AHRMEN1KMT2A | |
| SCHEMBL28363847 | 0.80 | THRB (0.41) | MAPTLMNATP53RXFP1THRB | |
| SCHEMBL28364142 | 0.79 | RXFP1 (0.43) | RXFP1MEN1KMT2A | |
| SCHEMBL28360376 | 0.79 | MCL1 (0.49) | L3MBTL1ALDH1A1HPGD | |
| SCHEMBL28364144 | 0.77 | SLC9A1 (0.41) | MAPTLMNAMEN1KMT2AALDH1A1 | |
| SCHEMBL28364015 | 0.77 | CNR2 (0.31) | MEN1KMT2AL3MBTL1 | |
| SCHEMBL13677550 | 0.68 | MAPT (0.46) | KMOMAPTLMNAAHRRXFP1 | |
| SCHEMBL7881270 | 0.68 | L3MBTL1 (0.59) | MAPTLMNATP53MTNR1AMTNR1B | |
| SCHEMBL10254076 | 0.66 | MCL1 (0.64) | KMOMAPTLMNATP53RXFP1 |
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-110669046-B | Polysubstituted tetrahydro-gamma-carboline derivative with multiple chiral centers and preparation method of stereo diversity of polysubstituted tetrahydro-gamma-carboline derivative | 武汉大学 | 2021-07-06 | — | — | CN | disclosed |