Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10554431 | 0.89 | ALDH1A1 (0.51) | NPC1HSD17B10LMNAKMT2AMEN1 | |
| SCHEMBL10551223 | 0.81 | GAA (0.49) | NPC1HSD17B10LMNAKMT2AMEN1 | |
| SCHEMBL4124062 | 0.76 | NPC1 (0.39) | NPC1LMNAKMT2AMEN1CYP1A2 | |
| SCHEMBL10550805 | 0.74 | KMT2A (0.54) | HSD17B10LMNAKMT2AMEN1CYP1A2 | |
| SCHEMBL11162182 | 0.70 | ALDH1A1 (0.49) | NPC1HSD17B10LMNAKMT2AMEN1 | |
| SCHEMBL29874882 | 0.69 | POLB (0.47) | NPC1HSD17B10KMT2AMEN1CYP1A2 | |
| SCHEMBL30467237 | 0.68 | POLB (0.46) | NPC1HSD17B10LMNAKMT2AMEN1 | |
| SCHEMBL10554827 | 0.67 | ALDH1A1 (0.48) | NPC1KMT2AMEN1CYP1A2CYP3A4 | |
| SCHEMBL29538871 | 0.66 | KMT2A (0.42) | HSD17B10LMNAKMT2AMEN1CYP1A2 | |
| SCHEMBL11817121 | 0.65 | HSD17B10 (0.50) | NPC1HSD17B10CHRM3CHRM1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4879293-A | NERVOUS SYSTEM AND PSYCHOSOMATIC DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1989-11-07 | — | — | US | disclosed |
| US-4788191-A | ANTIANXIETY AGENTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1988-11-29 | — | — | US | disclosed |
| US-4590189-A | ANTIANXIETY AGENTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1986-05-20 | — | — | US | disclosed |