Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.52 |
| ▸ | RAB9A | P51151 | 8/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 5/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.48 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11580216 | 0.81 | HTT (0.53) | NPC1RAB9AMEN1LMNAHTT | |
| SCHEMBL11663706 | 0.81 | RAB9A (0.53) | NPC1RAB9AMEN1LMNAHTT | |
| SCHEMBL11499893 | 0.81 | RAB9A (0.48) | NPC1RAB9AMEN1LMNAHTT | |
| SCHEMBL4651767 | 0.80 | RAB9A (0.71) | NPC1RAB9AMEN1LMNAHTT | |
| SCHEMBL11645843 | 0.79 | RAB9A (0.54) | NPC1RAB9AMEN1LMNAHTT | |
| SCHEMBL11477888 | 0.79 | CYP1A2 (0.53) | NPC1RAB9AMEN1LMNAHTT | |
| SCHEMBL11446246 | 0.78 | PAX8 (0.41) | NPC1RAB9AMEN1LMNAHTT | |
| SCHEMBL11459075 | 0.78 | MEN1 (0.46) | NPC1RAB9AMEN1LMNAHTT | |
| SCHEMBL11640701 | 0.77 | HTT (0.53) | NPC1RAB9AMEN1LMNAHTT | |
| SCHEMBL11640310 | 0.76 | RAB9A (0.51) | NPC1RAB9AMEN1LMNAHTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0018674-A1 | Benzodioxincarboxylic acid derivatives, their preparation and their inclusion in lipogenesis inhibiting compositions | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1980-11-12 | — | — | EP | disclosed |
| US-4205079-A | LIPORENESIS INHIBITORS | SHELL OIL COMPANY (US) | 1980-05-27 | — | — | US | disclosed |