Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | PKM | P14618 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9769406 | 0.84 | GAA (0.56) | NPC1KMT2AMEN1ALDH1A1LMNA | |
| SCHEMBL16146892 | 0.83 | THRB (0.44) | NPC1RAB9AKMT2AMEN1MAPT | |
| SCHEMBL13477751 | 0.82 | KMT2A (0.54) | NPC1RAB9AKMT2AMEN1MAPT | |
| SCHEMBL27778851 | 0.81 | KMT2A (0.53) | NPC1RAB9AKMT2AMEN1MAPT | |
| 1,2-Dipropoxybenzene SCHEMBL578657 | 0.79 | CYP1A2 (0.56) | NPC1RAB9AKMT2AMEN1MAPT | |
| 1,2-Dipropoxybenzene SCHEMBL29428926 | 0.79 | CYP1A2 (0.56) | NPC1RAB9AKMT2AMEN1MAPT | |
| SCHEMBL11222020 | 0.78 | KMT2A (0.57) | NPC1RAB9AKMT2AMEN1MAPT | |
| 1,2-Dipropoxybenzene SCHEMBL8910053 | 0.77 | CYP1A2 (0.54) | NPC1RAB9AKMT2AMEN1MAPT | |
| SCHEMBL8957741 | 0.77 | ALDH1A1 (0.54) | NPC1RAB9AKMT2AMEN1MAPT | |
| Hydrochloric Acid SCHEMBL6667018 | 0.77 | KMT2A (0.49) | NPC1RAB9AKMT2AMEN1MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1874736-A4 | FUSED HETEROCYCLIC COMPOUNDS | TAKEDA PHARMACEUTICAL (JP) | 2008-08-20 | — | — | EP | disclosed |
| EP-1874736-A2 | FUSED HETEROCYCLIC COMPOUNDS | Takeda Pharmaceutical Company Limited (JP) | 2008-01-09 | — | — | EP | disclosed |
| WO-2006116412-A2 | FUSED HETEROCYCLIC COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2006-11-02 | — | — | WO | disclosed |