Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 10/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 4/20 | 0.41 |
| ▸ | NQO1 | P15559 | 1/20 | 0.41 |
| ▸ | MGAM | O43451 | 2/20 | 0.39 |
| ▸ | SI | P14410 | 2/20 | 0.39 |
| ▸ | MGAM2 | Q2M2H8 | 2/20 | 0.39 |
| ▸ | RET | P07949 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2278888 | 0.84 | AHR (0.66) | AHRKDM4EALDH1A1HPGDMAPT | |
| SCHEMBL16503962 | 0.82 | ADORA3 (0.43) | AHRKDM4EALDH1A1HPGDMAPT | |
| SCHEMBL24589169 | 0.81 | AHR (0.53) | AHRKDM4EALDH1A1HPGDMAPT | |
| SCHEMBL22172199 | 0.78 | AHR (0.60) | AHRKDM4EALDH1A1HPGDMAPT | |
| SCHEMBL23690159 | 0.77 | AHR (0.50) | AHRKDM4EALDH1A1HPGDMAPT | |
| SCHEMBL23690166 | 0.77 | AHR (0.58) | AHRKDM4EALDH1A1HPGDMAPT | |
| SCHEMBL15840224 | 0.77 | KDM4E (0.48) | AHRKDM4EALDH1A1HPGDMAPT | |
| SCHEMBL22725170 | 0.77 | KDM4E (0.48) | AHRKDM4EALDH1A1HPGDMAPT | |
| SCHEMBL23560207 | 0.76 | AHR (0.72) | AHRKDM4EALDH1A1HPGDMAPT | |
| SCHEMBL7126109 | 0.76 | AHR (0.52) | AHRKDM4EALDH1A1HPGDMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022129116-A1 | INDOLO[3.2.1-JK]CARBAZOLE-6-CARBONITRILE DERIVATIVES AS BLUE FLUORESCENT EMITTERS FOR USE IN OLEDS | MERCK PATENT GMBH (DE) | 2022-06-23 | — | — | WO | disclosed |