Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.62 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CRHBP | P24387 | 1/20 | 0.44 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9609808 | 0.85 | SMN1; SMN2 (0.82) | MAPTSMN1; SMN2HPGDRAB9ANPC1 | |
| SCHEMBL5106835 | 0.82 | CYP17A1 (0.54) | MAPT | |
| SCHEMBL11661313 | 0.81 | MAPT (0.59) | MAPTSMN1; SMN2HPGDRAB9ANPC1 | |
| SCHEMBL11790359 | 0.80 | RAB9A (0.65) | MAPTSMN1; SMN2HPGDRAB9ANPC1 | |
| SCHEMBL6002799 | 0.80 | MAPT (0.62) | MAPTSMN1; SMN2HPGDRAB9ANPC1 | |
| SCHEMBL28098568 | 0.79 | SMN1; SMN2 (0.56) | MAPTSMN1; SMN2HPGDRAB9ANPC1 | |
| SCHEMBL4579588 | 0.79 | SMN1; SMN2 (0.61) | MAPTSMN1; SMN2HPGDRAB9ANPC1 | |
| SCHEMBL18171766 | 0.79 | LMNA (0.50) | MAPTHPGDRAB9ANPC1ALDH1A1 | |
| SCHEMBL6082066 | 0.79 | RAB9A (0.68) | MAPTSMN1; SMN2HPGDRAB9ANPC1 | |
| SCHEMBL7251623 | 0.79 | SMN1; SMN2 (0.72) | MAPTSMN1; SMN2HPGDRAB9ANPC1 |
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-107771176-A | The inhibitor of human immunodeficiency virus replication | VIIV保健英国第五有限公司 | 2018-03-06 | — | — | CN | disclosed |
| WO-2014160592-A2 | FACTOR XIa INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2014-10-02 | — | — | WO | disclosed |