Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | CASP3 | P42574 | 1/20 | 0.50 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.50 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.50 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | MIF | P14174 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28216697 | 0.82 | PLA2G7 (0.59) | NPC1RAB9AMIFMEN1KMT2A | |
| SCHEMBL11963957 | 0.82 | PLA2G7 (0.59) | NPC1RAB9AMIFMEN1KMT2A | |
| SCHEMBL28360449 | 0.81 | MIF (0.55) | NPC1CASP3SENP8SENP7SENP6 | |
| SCHEMBL13468797 | 0.76 | NPC1 (0.58) | NPC1CASP3SENP8SENP7SENP6 | |
| SCHEMBL28665731 | 0.75 | KMT2A (0.45) | NPC1CASP3SENP8SENP7SENP6 | |
| SCHEMBL29033274 | 0.74 | NPC1 (0.47) | NPC1CASP3SENP8SENP7SENP6 | |
| SCHEMBL12756964 | 0.73 | NPC1 (0.64) | NPC1CASP3SENP8SENP7SENP6 | |
| SCHEMBL28360431 | 0.73 | MIF (0.54) | CASP3SENP8SENP7SENP6MAPT | |
| SCHEMBL28349978 | 0.73 | NPC1 (0.50) | NPC1CASP3SENP8SENP7SENP6 | |
| SCHEMBL13044360 | 0.72 | KMT2A (0.53) | NPC1MAPTRAB9ASMN1; SMN2MIF |
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-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 |
| CN-110669046-A | 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 | 2020-01-10 | — | — | CN | disclosed |