Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.37 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | NQO2 | P16083 | 1/20 | 0.35 |
| ▸ | ATR | Q13535 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | FPR3 | P25089 | 2/20 | 0.33 |
| ▸ | FPR2 | P25090 | 2/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29872603 | 0.83 | MTNR1A (0.36) | NPC1RAB9AMTNR1AMTNR1BMEN1 | |
| SCHEMBL21594080 | 0.83 | MTNR1A (0.36) | NPC1RAB9AMTNR1AMTNR1BMEN1 | |
| SCHEMBL21591747 | 0.79 | MTNR1B (0.46) | MTNR1AMTNR1BNQO2MAPTHTT | |
| SCHEMBL21591739 | 0.78 | MTNR1B (0.41) | MTNR1AMTNR1BNQO2HPGDMAPT | |
| SCHEMBL21591617 | 0.78 | NPC1 (0.49) | NPC1RAB9AKDM4CL3MBTL1MEN1 | |
| SCHEMBL21591631 | 0.76 | NPC1 (0.52) | NPC1RAB9AKDM4CL3MBTL1MEN1 | |
| SCHEMBL3959022 | 0.75 | EPHX1 (0.51) | MEN1KMT2AEPHX1ATRHTT | |
| SCHEMBL23854684 | 0.74 | MTNR1B (0.46) | MTNR1AMTNR1BNQO2MAPTHTT | |
| SCHEMBL30570606 | 0.73 | MTNR1B (0.48) | MTNR1AMTNR1BNQO2MAPTHTT | |
| SCHEMBL23854724 | 0.73 | MTNR1B (0.48) | MTNR1AMTNR1BNQO2MAPTHTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3807270-A1 | NOVEL HETEROARYL HETEROCYCLYL COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE | F. Hoffmann-La Roche AG (CH) | 2021-04-21 | — | — | EP | disclosed |
| WO-2019238616-A1 | NOVEL HETEROARYL HETEROCYCLYL COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE | F. HOFFMANN-LA ROCHE AG (CH) | 2019-12-19 | — | — | WO | disclosed |