Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 0.44 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.44 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.44 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.44 |
| ▸ | CTNNB1 | P35222 | 3/20 | 0.42 |
| ▸ | WNT3A | P56704 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 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 | |
|---|---|---|---|---|
| SCHEMBL7859850 | 0.85 | KEAP1 (0.46) | MAPTTDP1LMNANR4A2HPGD | |
| SCHEMBL7140950 | 0.81 | EGFR (0.41) | MAPTLMNANR4A2GAACYP2C19 | |
| SCHEMBL31115079 | 0.81 | MAPT (0.49) | MAPTTDP1L3MBTL1LMNARAB9A | |
| SCHEMBL23804836 | 0.79 | CYP1A2 (0.51) | MAPTNR4A2ALDH1A1CYP2C19HDAC3 | |
| SCHEMBL4413665 | 0.77 | CYP1A2 (0.54) | MAPTTDP1L3MBTL1LMNAALDH1A1 | |
| SCHEMBL1650809 | 0.75 | KDM4E (0.50) | TDP1LMNAHPGDALDH1A1GAA | |
| SCHEMBL2961433 | 0.74 | TDP1 (0.37) | MAPTTDP1LMNARAB9AHPGD | |
| SCHEMBL27480509 | 0.74 | S1PR2 (0.41) | TDP1HPGDCYP2C19KMT2AKDM4E | |
| SCHEMBL10370767 | 0.73 | KDM4E (0.41) | MAPTTDP1L3MBTL1LMNANR4A2 | |
| SCHEMBL29580491 | 0.72 | GPR84 (0.68) | MAPTTDP1L3MBTL1LMNANR4A2 |
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-108570027-A | A kind of selective PI3K inhibitor for treating tumour | 王延娇 | 2018-09-25 | — | — | CN | disclosed |