Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 4/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.32 |
| ▸ | WNT3A | P56704 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22639071 | 0.87 | NPC1 (0.39) | HPGDMAPTNPC1RAB9AALDH1A1 | |
| SCHEMBL29883661 | 0.74 | CYP2C9 (0.51) | HPGDSMN1; SMN2KDM4EMEN1KMT2A | |
| SCHEMBL28298455 | 0.74 | CYP2C9 (0.51) | HPGDSMN1; SMN2KDM4EMEN1KMT2A | |
| SCHEMBL22639070 | 0.72 | DNMT1 (0.39) | HPGDMAPTNPC1RAB9AALDH1A1 | |
| SCHEMBL27744 | 0.71 | CES2 (0.44) | HPGDALDH1A1SMN1; SMN2KDM4EPTPN1 | |
| SCHEMBL28494595 | 0.70 | CES2 (0.42) | ALDH1A1SMN1; SMN2KDM4EALOX15CES2 | |
| SCHEMBL22639072 | 0.68 | PTPN1 (0.37) | HPGDMAPTNPC1RAB9AALDH1A1 | |
| SCHEMBL20924693 | 0.68 | FFAR1 (0.44) | MAPTNPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL5717731 | 0.68 | HPGD (0.47) | HPGDMAPTNPC1RAB9AALDH1A1 | |
| Benzene SCHEMBL28280478 | 0.68 | CES2 (0.44) | MAPTALDH1A1ALOX15CES2CES1 |
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-112204035-A | Substituted 3,4,12,12 a-tetrahydro-1 n1- [1,4] oxazino [3,4-c ] pyrido [2,1-f ] [1,2,4] triazine-6, 8-diones, pharmaceutical compositions, methods of production and uses thereof | 亚历山大·瓦西里耶维奇·伊瓦切恩科 | 2021-01-08 | — | — | CN | disclosed |