Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | FAAH | O00519 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | PLK1 | P53350 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL10878950 | 0.95 | MEN1 (0.57) | MEN1KMT2AMAPTGAAFAAH | |
| SCHEMBL21595691 | 0.85 | LMNA (0.66) | MEN1KMT2AMAPTLMNATP53 | |
| SCHEMBL14102238 | 0.85 | L3MBTL1 (0.54) | MEN1KMT2AMAPTLMNATP53 | |
| SCHEMBL21595884 | 0.83 | CYP1A2 (0.50) | MEN1KMT2AMAPTLMNATP53 | |
| SCHEMBL20874025 | 0.83 | LMNA (0.49) | MEN1KMT2AMAPTLMNATP53 | |
| SCHEMBL21595781 | 0.83 | CHRNB2 (0.49) | MEN1KMT2AMAPTGAAFAAH | |
| SCHEMBL7993485 | 0.83 | RAB9A (0.68) | MEN1KMT2AMAPTLMNATP53 | |
| SCHEMBL21595906 | 0.81 | KMT2A (0.43) | MEN1KMT2AMAPTGAALMNA | |
| SCHEMBL21595783 | 0.81 | MRGPRX4 (0.47) | MEN1KMT2AMAPTGAALMNA | |
| SCHEMBL21595643 | 0.81 | ALDH1A1 (0.60) | MAPTLMNATP53SMN1; SMN2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019244066-A2 | PYRIDIN-3-YL ACETIC ACID DERIVATIVES AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | VIIV Healthcare UK (No.5) Limited (GB) | 2019-12-26 | — | — | WO | disclosed |