Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGAM | O43451 | 1/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.45 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.45 |
| ▸ | AURKA | O14965 | 1/20 | 0.45 |
| ▸ | DHFR | P00374 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.42 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | CSF1R | P07333 | 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 | |
|---|---|---|---|---|
| SCHEMBL10474372 | 0.85 | MGAM (0.57) | MGAMSRD5A2 | |
| SCHEMBL18372036 | 0.76 | SMN1; SMN2 (0.49) | MGAMNPC1RAB9ASRD5A2 | |
| SCHEMBL22376 | 0.76 | MGAM (0.57) | MGAMSRD5A2 | |
| SCHEMBL5447688 | 0.75 | SRD5A2 (0.69) | AKR1C3AKR1C2EPHX2TRPV1NPC1 | |
| SCHEMBL1352938 | 0.74 | HDAC6 (0.57) | MGAM | |
| SCHEMBL10465639 | 0.74 | MGAM (0.70) | MGAMNPC1RAB9AMEN1KMT2A | |
| SCHEMBL13279924 | 0.74 | AKR1C3 (0.78) | AKR1C3AKR1C2AURKAEPHX2NPC1 | |
| SCHEMBL1644022 | 0.74 | MGAM (0.57) | MGAMEPHX2TRPV1SRD5A2 | |
| SCHEMBL12133241 | 0.73 | ALOX15 (0.50) | MGAMABCG2NPC1RAB9AMEN1 | |
| SCHEMBL12133496 | 0.73 | HDAC6 (0.48) | NPC1RAB9APOLBMAPT |
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-105722840-B | fused quinoline compound as PI3K, mTOR inhibitors | 杭州爱德程医药科技有限公司 | 2018-01-05 | — | — | CN | disclosed |
| CN-105722840-A | Fused quinoline compunds as PI3K, mTOR inhibitors | 杭州爱德程医药科技有限公司 | 2016-06-29 | — | — | CN | disclosed |