Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8315486 | 0.85 | NPC1 (0.39) | PGRMAPTRAB9ASMN1; SMN2TP53 | |
| SCHEMBL8315585 | 0.84 | ADRA1A (0.40) | PGRMAPTRAB9ASMN1; SMN2TP53 | |
| SCHEMBL8312863 | 0.84 | MAPT (0.39) | PGRMAPTRAB9ASMN1; SMN2TP53 | |
| SCHEMBL8314584 | 0.84 | FABP6 (0.37) | PGRMAPTRAB9ATGFBR1BACE1 | |
| SCHEMBL8316184 | 0.83 | KDM4E (0.37) | HTR7MAPTRAB9ASMN1; SMN2TP53 | |
| SCHEMBL8313611 | 0.82 | NPC1 (0.41) | HTR2BTMEM97SIGMAR1HTR7HTR1A | |
| SCHEMBL8314548 | 0.82 | NPC1 (0.35) | MAPTRAB9ASMN1; SMN2TP53PKM | |
| SCHEMBL8310538 | 0.82 | GABRA1 (0.34) | MAPTRAB9ASMN1; SMN2TP53PKM | |
| SCHEMBL8312741 | 0.81 | CBFB (0.39) | MAPTRAB9ASMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL8313790 | 0.81 | TGFBR1 (0.39) | MAPTKDM4EALDH1A1TSHRTGFBR1 |
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-0626954-B1 | BENZOCYCLOHEPTENES, BENZOXEPINES AND BENZOTHIEPINES | MERCK PATENT GMBH (DE) | 1999-03-17 | — | — | EP | disclosed |
| US-5602152-A | POTASSIUM CHANNEL MODULATOR | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1997-02-11 | — | — | US | disclosed |
| WO-1994013658-A2 | BENZOCYCLOHEPTENES, BENZOXEPINES AND BENZOTHIEPINES | MERCK PATENT GMBH (DE) | 1994-06-23 | — | — | WO | disclosed |