Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | CASP3 | P42574 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.50 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.50 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.50 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.46 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.46 |
| ▸ | NTRK2 | Q16620 | 2/20 | 0.46 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.46 |
| ▸ | FYN | P06241 | 1/20 | 0.46 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.45 |
| ▸ | FLT3 | P36888 | 2/20 | 0.45 |
| ▸ | GSK3B | P49841 | 2/20 | 0.45 |
| ▸ | JAK2 | O60674 | 1/20 | 0.45 |
| ▸ | MET | P08581 | 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 | |
|---|---|---|---|---|
| SCHEMBL12727793 | 0.88 | NPC1 (0.50) | MAPK1NPC1LMNACASP3RAB9A | |
| SCHEMBL19251116 | 0.85 | PARP10 (0.64) | MAPK1NPC1LMNACASP3RAB9A | |
| SCHEMBL12220207 | 0.83 | CLK4 (0.51) | NPC1CASP3RAB9ASENP8SENP7 | |
| SCHEMBL27086074 | 0.81 | PARP1 (0.50) | CLK4DYRK1BNTRK2TYRO3FYN | |
| SCHEMBL29871724 | 0.81 | CLK4 (0.49) | CLK4DYRK1BNTRK2TYRO3FYN | |
| SCHEMBL10061001 | 0.79 | TDP2 (0.56) | MAPK1NPC1LMNACASP3RAB9A | |
| SCHEMBL22886507 | 0.78 | CLK4 (0.39) | MAPK1NPC1LMNACASP3RAB9A | |
| SCHEMBL10060999 | 0.77 | NPC1 (0.42) | MAPK1NPC1LMNACASP3RAB9A | |
| SCHEMBL30681290 | 0.77 | PARP10 (0.71) | CLK4DYRK1BNTRK2TYRO3FYN | |
| SCHEMBL10269253 | 0.77 | MAPK1 (0.46) | MAPK1NPC1LMNACASP3RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-9732083-B2 | Tricyclic gyrase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2017-08-15 | — | — | US | disclosed |