Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR3 | P49682 | 4/20 | 0.61 |
| ▸ | RAB9A | P51151 | 3/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | ATM | Q13315 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | MGAM | O43451 | 1/20 | 0.55 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | SI | P14410 | 1/20 | 0.55 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.55 |
| ▸ | GSK3B | P49841 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | TSPO | P30536 | 2/20 | 0.51 |
| ▸ | BRSK1 | Q8TDC3 | 1/20 | 0.50 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL27890324 | 0.83 | IDO1 (0.61) | RAB9AKMT2AATMKDM4EGAA | |
| SCHEMBL14373251 | 0.82 | CXCR3 (0.81) | CXCR3RAB9AKMT2AATMKDM4E | |
| SCHEMBL5461913 | 0.76 | CXCR3 (0.76) | CXCR3RAB9AKMT2AATMKDM4E | |
| SCHEMBL14758273 | 0.76 | CXCR3 (1.00) | CXCR3RAB9AKMT2AATMMEN1 | |
| SCHEMBL27547403 | 0.74 | KDM4E (0.72) | KMT2AKDM4EMEN1TSPOGLA | |
| SCHEMBL5449881 | 0.74 | CXCR3 (0.77) | CXCR3RAB9AKMT2AATMKDM4E | |
| SCHEMBL5460666 | 0.74 | MAPT (0.69) | CXCR3RAB9AKMT2AATMKDM4E | |
| SCHEMBL14373481 | 0.74 | CXCR3 (0.77) | CXCR3RAB9AKMT2AATMMEN1 | |
| SCHEMBL14003754 | 0.74 | KDM4E (0.73) | KDM4ETSPOCYP2C19HDAC1HDAC6 | |
| SCHEMBL14003751 | 0.74 | KDM4E (0.73) | KDM4ETSPOCYP2C19HDAC1HDAC6 |
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-110078656-A | Intramolecular reverses electric charge transfer triplet electroluminescent material and device | 北京大学 | 2019-08-02 | — | — | CN | claimed |
| CN-110078656-A | Intramolecular reverses electric charge transfer triplet electroluminescent material and device | 北京大学 | 2019-08-02 | — | — | CN | disclosed |