Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 2/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.42 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARD | Q03181 | 1/20 | 0.37 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | REN | P00797 | 1/20 | 0.35 |
| ▸ | MMP1 | P03956 | 3/20 | 0.35 |
| ▸ | MMP2 | P08253 | 2/20 | 0.35 |
| ▸ | MMP3 | P08254 | 2/20 | 0.35 |
| ▸ | MMP9 | P14780 | 2/20 | 0.35 |
| ▸ | MMP12 | P39900 | 2/20 | 0.35 |
| ▸ | MMP13 | P45452 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL26456935 | 1.00 | ADRA1D (0.42) | ADRA1DADRA1AADRA1BSIGMAR1KMT2A | |
| SCHEMBL30131020 | 1.00 | ADRA1D (0.42) | ADRA1DADRA1AADRA1BSIGMAR1KMT2A | |
| SCHEMBL23929171 | 0.88 | MEN1 (0.41) | SIGMAR1KMT2AMEN1ALDH1A1BCHE | |
| SCHEMBL23929173 | 0.88 | MEN1 (0.41) | SIGMAR1KMT2AMEN1ALDH1A1BCHE | |
| SCHEMBL23929146 | 0.84 | CYP3A4 (0.40) | ADRA1ASIGMAR1LMNATP53CYP1A2 | |
| SCHEMBL23929148 | 0.84 | CYP3A4 (0.40) | ADRA1ASIGMAR1LMNATP53CYP1A2 | |
| SCHEMBL30211119 | 0.84 | CYP3A4 (0.40) | ADRA1ASIGMAR1LMNATP53CYP1A2 | |
| SCHEMBL18330762 | 0.82 | ADRA1A (0.52) | ADRA1DADRA1AADRA1BSIGMAR1KMT2A | |
| SCHEMBL28976136 | 0.82 | ALOX15 (0.36) | ADRA1DADRA1AADRA1BSIGMAR1KMT2A | |
| SCHEMBL26456931 | 0.82 | ALOX15 (0.36) | ADRA1DADRA1AADRA1BSIGMAR1KMT2A |
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-117642405-A | Salt form of tricyclic tetrahydroisoquinoline derivative | 江苏恒瑞医药股份有限公司 | 2024-03-01 | — | — | CN | disclosed |
| CN-114746424-B | Tricyclic tetrahydroisoquinoline derivative, preparation method and application thereof in medicine | 江苏恒瑞医药股份有限公司 | 2023-06-16 | — | — | CN | disclosed |
| CN-114746424-A | Tricyclic tetrahydro isoquinoline derivative, preparation method and medical application thereof | 江苏恒瑞医药股份有限公司 | 2022-07-12 | — | — | CN | disclosed |