Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | AOC2 | O75106 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28196633 | 0.82 | ATM (0.44) | MEN1NPC1RAB9AKMT2AATM | |
| SCHEMBL13508827 | 0.80 | TSHR (0.42) | TSHRMEN1NPC1RAB9AKMT2A | |
| SCHEMBL21551645 | 0.79 | ATM (0.45) | TSHRMEN1NPC1RAB9AKMT2A | |
| SCHEMBL473212 | 0.78 | ATM (0.47) | TSHRMEN1NPC1RAB9AKMT2A | |
| SCHEMBL28419898 | 0.78 | PPARG (0.44) | TSHRMEN1NPC1RAB9AKMT2A | |
| SCHEMBL7064558 | 0.77 | TDP1 (0.50) | TSHRMEN1NPC1RAB9AKMT2A | |
| SCHEMBL650229 | 0.75 | ELANE (0.50) | TSHRMEN1NPC1RAB9AKMT2A | |
| SCHEMBL16317914 | 0.75 | TDP1 (0.41) | TSHRMEN1NPC1RAB9AKMT2A | |
| SCHEMBL28806667 | 0.75 | PPARG (0.45) | TSHRMEN1NPC1RAB9AKMT2A | |
| SCHEMBL217413 | 0.75 | TSHR (0.45) | TSHRMEN1NPC1RAB9AKMT2A |
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-2018093695-A1 | FACTOR XIIa INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2018-05-24 | — | — | WO | disclosed |