Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.48 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 6/20 | 0.46 |
| ▸ | RAB9A | P51151 | 5/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 6/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | PLK1 | P53350 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ITK | Q08881 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL12440778 | 0.90 | NPC1 (0.49) | EGFRNR1H4ALDH1A1NPC1RAB9A | |
| SCHEMBL12440769 | 0.89 | NPC1 (0.56) | EGFRNR1H4ALDH1A1NPC1RAB9A | |
| SCHEMBL12440811 | 0.85 | PLK1 (0.45) | EGFRALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL12440765 | 0.83 | NPC1 (0.54) | EGFRNR1H4ALDH1A1HPGDNPC1 | |
| SCHEMBL12440757 | 0.81 | NPC1 (0.59) | EGFRALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL12440789 | 0.80 | NR1H4 (0.52) | NR1H4NPC1RAB9ASMN1; SMN2PKM | |
| SCHEMBL18177284 | 0.80 | EGFR (0.44) | EGFRNR1H4ALDH1A1HPGDNPC1 | |
| SCHEMBL13754033 | 0.80 | ALDH1A1 (0.61) | EGFRNR1H4ALDH1A1NPC1RAB9A | |
| SCHEMBL12440756 | 0.79 | ALDH1A1 (0.55) | ALDH1A1HPGDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL12440754 | 0.79 | PLK1 (0.50) | ALDH1A1HPGDNPC1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-8519040-B2 | Ionic organic compound, production method thereof, hydrogelling agent composed of the ionic organic compound, hydrogel containing same, methanol gelling agent, methanol gel containing same, and carbon nanotube dispersant | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2013-08-27 | — | — | US | disclosed |
| US-20110178218-A1 | IONIC ORGANIC COMPOUND, PRODUCTION METHOD THEREOF, HYDROGELLING AGENT COMPOSED OF THE IONIC ORGANIC COMPOUND, HYDROGEL CONTAINING SAME, METHANOL GELLING AGENT, METHANOL GEL CONTAINING SAME, AND CARBON NANOTUBE DISPERSANT | National Institute of Avanced Industrial Science and Technology (JP) | 2011-07-21 | — | — | US | disclosed |