Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 1/20 | 0.62 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.55 |
| ▸ | RELA | Q04206 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.50 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ABL1 | P00519 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.47 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28047701 | 0.90 | CYP3A4 (0.61) | FFAR1NFKB1NFKB2RELACYP3A4 | |
| SCHEMBL9755689 | 0.89 | FFAR1 (0.54) | FFAR1NFKB1NFKB2RELACYP3A4 | |
| SCHEMBL6276169 | 0.85 | FFAR1 (0.71) | FFAR1CYP3A4SLC5A1SLC5A2HPGD | |
| SCHEMBL28047696 | 0.81 | FFAR1 (0.57) | FFAR1CYP3A4USP2MAPK1SMN1; SMN2 | |
| SCHEMBL30996080 | 0.79 | NFKB1 (0.60) | NFKB1NFKB2RELACYP3A4USP2 | |
| SCHEMBL11281708 | 0.79 | NFKB1 (0.53) | NFKB1NFKB2RELACYP3A4USP2 | |
| SCHEMBL28047855 | 0.78 | NPC1 (0.62) | CYP3A4MAPK1SMN1; SMN2HPGDMAPT | |
| SCHEMBL11097225 | 0.78 | NFKB1 (0.58) | NFKB1NFKB2RELACYP3A4USP2 | |
| SCHEMBL31580496 | 0.77 | FFAR1 (1.00) | FFAR1 | |
| SCHEMBL11851967 | 0.76 | NFKB1 (0.66) | FFAR1NFKB1NFKB2RELACYP3A4 |
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-105189446-A | Phloroglucinol derivatives and application thereof in treatment of neurodegenerative disorder | INST MATERIA MEDICA CAMS | 2015-12-23 | — | — | CN | disclosed |