Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.49 |
| ▸ | MGAM | O43451 | 6/20 | 0.47 |
| ▸ | GAA | P10253 | 6/20 | 0.47 |
| ▸ | SI | P14410 | 6/20 | 0.47 |
| ▸ | MGAM2 | Q2M2H8 | 6/20 | 0.47 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.47 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.47 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.46 |
| ▸ | ASH1L | Q9NR48 | 1/20 | 0.45 |
| ▸ | KIF11 | P52732 | 1/20 | 0.44 |
| ▸ | CDK2 | P24941 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.42 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.42 |
| ▸ | PGR | P06401 | 1/20 | 0.42 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28885915 | 0.87 | NR4A2 (0.50) | GPR84MGAMGAASIMGAM2 | |
| SCHEMBL28375303 | 0.83 | GPR84 (0.51) | GPR84MGAMGAASIMGAM2 | |
| SCHEMBL28369949 | 0.79 | NR4A2 (0.58) | GPR84MGAMGAASIMGAM2 | |
| SCHEMBL8804759 | 0.77 | NR3C1 (0.62) | MGAMGAASIMGAM2RAB9A | |
| SCHEMBL27586464 | 0.77 | ALDH1A1 (0.56) | GPR84MGAMGAASIMGAM2 | |
| SCHEMBL28373306 | 0.76 | CREBBP (0.41) | NR4A2CREBBPRAB9AKMT2A | |
| SCHEMBL17912674 | 0.76 | NR4A2 (0.54) | GPR84MGAMGAASIMGAM2 | |
| SCHEMBL28373799 | 0.76 | KMT2A (0.41) | NR4A2CREBBPRAB9AMEN1KMT2A | |
| SCHEMBL21383576 | 0.74 | NR3C1 (0.58) | GPR84MGAMGAASIMGAM2 | |
| SCHEMBL5881120 | 0.73 | NR4A2 (0.55) | GPR84MGAMGAASIMGAM2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107149602-B | Application of indole compounds and derivatives thereof in preparation of anti-HIV drugs | 中国医学科学院药物研究所 | 2020-10-09 | — | — | CN | disclosed |
| CN-107149603-B | Application of indole compounds and derivatives thereof in preparation of anti-influenza virus drugs | 中国医学科学院药物研究所 | 2020-07-14 | — | — | CN | disclosed |
| CN-107176921-B | Indole compounds with antiviral activity in isatis root and derivatives thereof | 中国医学科学院药物研究所 | 2020-03-31 | — | — | CN | disclosed |