Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 3/20 | 0.51 |
| ▸ | BCHE | P06276 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SSTR1 | P30872 | 3/20 | 0.39 |
| ▸ | SSTR2 | P30874 | 3/20 | 0.39 |
| ▸ | SSTR4 | P31391 | 3/20 | 0.39 |
| ▸ | SSTR3 | P32745 | 3/20 | 0.39 |
| ▸ | SSTR5 | P35346 | 3/20 | 0.39 |
| ▸ | GJB2 | P29033 | 2/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | TACR1 | P25103 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | GYPA | P02724 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL20010819 | 0.82 | PDE4D (0.52) | PDE4DBCHEACHESLC6A2SSTR1 | |
| SCHEMBL24058165 | 0.82 | PDE4D (0.58) | PDE4DBCHEACHESLC6A2SSTR1 | |
| SCHEMBL8933680 | 0.82 | PDE4D (0.52) | PDE4DBCHEACHESLC6A2SSTR1 | |
| SCHEMBL31556052 | 0.82 | PDE4D (0.58) | PDE4DBCHEACHESLC6A2SSTR1 | |
| SCHEMBL7570823 | 0.81 | PDE4D (0.57) | PDE4DBCHEACHESLC6A2SSTR1 | |
| SCHEMBL7570826 | 0.81 | PDE4D (0.57) | PDE4DBCHEACHESLC6A2SSTR1 | |
| SCHEMBL7570831 | 0.81 | PDE4D (0.57) | PDE4DBCHEACHESLC6A2SSTR1 | |
| SCHEMBL7564024 | 0.81 | PDE4D (0.51) | PDE4DBCHEACHESLC6A2SSTR1 | |
| SCHEMBL7564028 | 0.81 | PDE4D (0.51) | PDE4DBCHEACHESLC6A2SSTR1 | |
| SCHEMBL7564020 | 0.81 | PDE4D (0.51) | PDE4DBCHEACHESLC6A2SSTR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2280987-B1 | TRITERPENE SAPONINS, METHODS OF SYNTHESIS, AND USES THEREOF | SLOAN KETTERING INST CANCER RES (US) | 2018-05-23 | — | — | EP | disclosed |