Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.45 |
| ▸ | NOS1 | P29475 | 4/20 | 0.44 |
| ▸ | AXL | P30530 | 2/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | JAK1 | P23458 | 1/20 | 0.42 |
| ▸ | METAP2 | P50579 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | DHPS | P49366 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | RAF1 | P04049 | 1/20 | 0.35 |
| ▸ | BRAF | P15056 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | RET | P07949 | 1/20 | 0.35 |
| ▸ | KIF5B | P33176 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10264250 | 0.71 | DRD2 (0.58) | IDO1NOS1AXLMETAP2BRD4 | |
| SCHEMBL21259457 | 0.71 | IDO1 (0.46) | IDO1NOS1AXLMETAP2 | |
| SCHEMBL1453289 | 0.70 | HTR1B (0.40) | ALDH1A1NPC1HTTRAB9A | |
| SCHEMBL691687 | 0.70 | LMNA (0.49) | MAPTALDH1A1LMNACYP1A2CYP3A4 | |
| SCHEMBL29416223 | 0.69 | IDO1 (0.51) | IDO1NOS1AXLJAK2JAK1 | |
| SCHEMBL12166325 | 0.69 | IDO1 (0.51) | IDO1NOS1AXLJAK2JAK1 | |
| SCHEMBL28358722 | 0.69 | KDM4E (0.42) | IDO1ALDH1A1NPC1LMNACYP1A2 | |
| SCHEMBL2633084 | 0.68 | IDO1 (0.55) | IDO1NOS1AXLJAK2JAK1 | |
| SCHEMBL691136 | 0.68 | KDM4E (0.41) | POLBMAPTALDH1A1NPC1LMNA | |
| SCHEMBL24652885 | 0.68 | IDO1 (0.48) | IDO1NOS1AXLJAK2JAK1 |
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-105829308-B | Isochromene derivatives as phosphoinositide 3-kinase inhibitors | 奇斯药制品公司 | 2019-03-08 | — | — | CN | disclosed |
| CN-105829308-A | Isochromene derivatives as phosphoinositide 3-kinase inhibitors | 奇斯药制品公司 | 2016-08-03 | — | — | CN | disclosed |