Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.45 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.45 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28643500 | 0.83 | THRB (0.51) | NPC1RAB9ASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL9015298 | 0.81 | TSHR (0.58) | NPC1RAB9ACYP2C19THRBPOLB | |
| SCHEMBL28088400 | 0.80 | RAB9A (0.50) | NPC1RAB9ASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL3633444 | 0.80 | NPC1 (0.59) | NPC1RAB9ACYP2C19THRBPOLB | |
| Acrylic Acid SCHEMBL31590930 | 0.80 | THRB (0.51) | NPC1RAB9ASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL28711480 | 0.80 | NPC1 (0.55) | NPC1RAB9ASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL28825805 | 0.79 | NPC1 (0.58) | NPC1RAB9ACYP2C19THRBPOLB | |
| SCHEMBL28050460 | 0.79 | NPC1 (0.58) | NPC1RAB9ACYP2C19THRBPOLB | |
| SCHEMBL9931139 | 0.79 | CYP2C19 (0.47) | NPC1RAB9ASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL28050508 | 0.79 | NPC1 (0.58) | NPC1RAB9ACYP2C19THRBPOLB |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114940654-B | Method for synthesizing adiponitrile and adipate compound by reductive dimerization of olefin under photocatalysis | 武汉大学 | 2023-03-10 | — | — | CN | disclosed |
| CN-114940654-A | Method for synthesizing adiponitrile and adipate compound by reductive dimerization of olefin under photocatalysis | 武汉大学 | 2022-08-26 | — | — | CN | disclosed |
| CN-113264861-B | Preparation method of alkyl dithiocarbamate | 河南农业大学 | 2022-08-26 | — | — | CN | disclosed |
| CN-113264861-A | Preparation method of alkyl dithiocarbamate | 河南农业大学 | 2021-08-17 | — | — | CN | disclosed |
| CN-104768939-A | HIGH REFRACTIVE (META)ACRYLATE AND THE METHOD FOR PREPARING THE SAME | DAELIM CHEMICAL CO LTD | 2015-07-08 | — | — | CN | disclosed |
| EP-0403159-A2 | Imidazolyl-alkenoic acids | SMITHKLINE BEECHAM CORPORATION (US) | 1990-12-19 | — | — | EP | disclosed |