Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 7/20 | 0.32 |
| ▸ | RAB9A | P51151 | 6/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1708702 | 0.84 | P2RX7 (0.35) | HTR2AMAPTALDH1A1MAPK1P2RX7 | |
| SCHEMBL1708581 | 0.83 | POLB (0.31) | MAPTTP53POLBNPC1RAB9A | |
| SCHEMBL1707749 | 0.82 | MAPT (0.34) | MAPTALDH1A1MAPK1TP53POLB | |
| SCHEMBL1707705 | 0.82 | LTB4R (0.33) | HTR2ABACE1BACE2 | |
| SCHEMBL3715294 | 0.81 | LMNA (0.38) | MAPTALDH1A1MAPK1TP53NPC1 | |
| SCHEMBL1707824 | 0.81 | NPC1 (0.37) | MAPTMAPK1NPC1RAB9AKMT2A | |
| SCHEMBL10011110 | 0.78 | FFAR1 (0.48) | — | |
| SCHEMBL10009234 | 0.78 | FFAR1 (0.48) | — | |
| SCHEMBL10011831 | 0.78 | FFAR1 (0.48) | — | |
| SCHEMBL1708112 | 0.77 | TSHR (0.38) | MAPTALDH1A1MAPK1NPC1LMNA |
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-2010143733-A1 | NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-12-16 | — | — | WO | disclosed |