Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 4/20 | 0.59 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.50 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MITF | O75030 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.45 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
| ▸ | SRC | P12931 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28369949 | 0.86 | NR4A2 (0.58) | NR4A2HTR2AHTR2CHTR2BMEN1 | |
| SCHEMBL28369579 | 0.77 | PLA2G2A (0.40) | NR4A2MTNR1AMTNR1BKMT2A | |
| SCHEMBL28373016 | 0.77 | MTNR1A (0.39) | NR4A2MTNR1AMTNR1BKMT2A | |
| SCHEMBL5068806 | 0.76 | NR4A2 (1.00) | NR4A2LMNAMEN1MAPTRAB9A | |
| SCHEMBL28375664 | 0.74 | KMT2A (0.47) | NR4A2HTR2AHTR2CHTR2BKMT2A | |
| SCHEMBL29003613 | 0.73 | HTR2B (0.59) | NR4A2MTNR1AMTNR1BHTR2AHTR2C | |
| SCHEMBL8804759 | 0.73 | NR3C1 (0.62) | LMNAMEN1MAPTRAB9AKMT2A | |
| SCHEMBL30513840 | 0.72 | HTR2A (0.46) | NR4A2MTNR1AMTNR1BHTR2AHTR2C | |
| SCHEMBL14880397 | 0.71 | MTNR1A (0.64) | NR4A2MTNR1AMTNR1BHTR2AHTR2C | |
| SCHEMBL10670278 | 0.71 | MTNR1A (0.60) | NR4A2MTNR1AMTNR1BHTR2AHTR2C |
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 |