Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.35 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | F2R | P25116 | 1/20 | 0.33 |
| ▸ | MIF | P14174 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL22308161 | 0.85 | ALDH1A1 (0.33) | NPC1RAB9AKMT2AALDH1A1HPGD | |
| SCHEMBL21842993 | 0.81 | F2R (0.40) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL22307186 | 0.80 | F2R (0.33) | NPC1RAB9AKMT2AMEN1AHR | |
| SCHEMBL22307183 | 0.80 | ALDH1A1 (0.31) | ALDH1A1CYP2C19 | |
| SCHEMBL25119548 | 0.79 | MIF (0.39) | NPC1RAB9AKMT2AMEN1AHR | |
| SCHEMBL2134095 | 0.78 | SMN1; SMN2 (0.37) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL257409 | 0.77 | LMNA (0.50) | RAB9AKMT2AMEN1ALDH1A1HSD17B10 | |
| SCHEMBL30280732 | 0.77 | LMNA (0.50) | RAB9AKMT2AMEN1ALDH1A1HSD17B10 | |
| SCHEMBL4509521 | 0.76 | C1S (0.39) | ALDH1A1HPGDHSD17B10MAPTMIF | |
| SCHEMBL30906644 | 0.74 | NPC1 (0.40) | NPC1RAB9AKMT2AMEN1AHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022022600-A1 | IMMUNOMODULATORS, COMPOSITIONS AND METHODS THEREOF | BETTA PHARMACEUTICALS CO., LTD (CN) | 2022-02-03 | — | — | WO | disclosed |
| WO-2020156323-A1 | IMMUNOMODULATORS, COMPOSITIONS AND METHODS THEREOF | BETTA PHARMACEUTICALS CO., LTD (CN) | 2020-08-06 | — | — | WO | disclosed |
| WO-2020015717-A1 | IMMUNOMODULATORS, COMPOSITIONS AND METHODS THEREOF | BETTA PHARMACEUTICALS CO., LTD (CN) | 2020-01-23 | — | — | WO | disclosed |