Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 3/20 | 0.45 |
| ▸ | TLR8 | Q9NR97 | 3/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | USP2 | O75604 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.37 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | NCF1 | P14598 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL29172695 | 0.91 | KCNH2 (0.43) | MCHR1TLR8MEN1KMT2AUSP2 | |
| SCHEMBL6530888 | 0.89 | TLR8 (0.41) | MCHR1TLR8MEN1KMT2AUSP2 | |
| SCHEMBL27805707 | 0.84 | TLR8 (0.44) | MCHR1TLR8NOS1TSHRMEN1 | |
| SCHEMBL3822501 | 0.77 | NOS2 (0.44) | MCHR1TLR8NOS1TSHRMEN1 | |
| SCHEMBL8348332 | 0.74 | HRH1 (0.42) | TLR8MAPT | |
| Hydrochloric Acid SCHEMBL5743709 | 0.73 | ALOX5AP (0.36) | MCHR1TLR8NOS1TLR7 | |
| SCHEMBL4652320 | 0.73 | NOS2 (0.41) | NOS1CASP1 | |
| SCHEMBL27769288 | 0.73 | KCNH2 (0.58) | ALDH1A1LMNACYP3A4KCNH2KDM4E | |
| SCHEMBL27634918 | 0.73 | KCNH2 (0.44) | TLR8ALDH1A1LMNACYP3A4KCNH2 | |
| SCHEMBL27977748 | 0.73 | KCNH2 (0.58) | ALDH1A1LMNACYP3A4KCNH2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-108250142-B | Amine compounds having anti-inflammatory, antifungal, antiparasitic and anticancer activity | 维尔斯达医疗公司 | 2021-01-26 | — | — | CN | disclosed |