Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.66 |
| ▸ | RAB9A | P51151 | 4/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.66 |
| ▸ | TSHR | P16473 | 1/20 | 0.66 |
| ▸ | MEN1 | O00255 | 3/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.50 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.49 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9527973 | 0.92 | NPC1 (0.56) | NPC1RAB9ASMN1; SMN2TSHRMEN1 | |
| SCHEMBL17550873 | 0.84 | RAB9A (0.59) | NPC1RAB9ASMN1; SMN2TSHRMEN1 | |
| SCHEMBL9528273 | 0.83 | KMT2A (0.52) | NPC1RAB9ASMN1; SMN2TSHRMEN1 | |
| SCHEMBL9407487 | 0.82 | CTSK (0.46) | NPC1RAB9ASMN1; SMN2TSHRMEN1 | |
| SCHEMBL7998297 | 0.82 | RAB9A (0.60) | NPC1RAB9ASMN1; SMN2TSHRMEN1 | |
| SCHEMBL17550880 | 0.80 | SMN1; SMN2 (0.55) | NPC1RAB9ASMN1; SMN2TSHRMEN1 | |
| SCHEMBL19750482 | 0.80 | RAB9A (0.55) | NPC1RAB9ASMN1; SMN2TSHRMEN1 | |
| SCHEMBL4076346 | 0.80 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2TSHRMEN1 | |
| SCHEMBL7980661 | 0.78 | RAB9A (0.64) | NPC1RAB9ASMN1; SMN2TSHRMEN1 | |
| SCHEMBL9407494 | 0.78 | GAA (0.58) | NPC1RAB9ASMN1; SMN2KMT2ALMNA |
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-0301751-B1 | PYRIDINIUM DERIVATIVES, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1993-03-10 | — | — | EP | disclosed |
| US-4962113-A | PLATELET ACTIVATING FACTOR ANTAGONISTS | TAKEDA CHEMICAL INDUSTRIES, LTD (JP) | 1990-10-09 | — | — | US | disclosed |
| EP-0301751-A1 | Pyridinium derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1989-02-01 | — | — | EP | disclosed |