Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | USP5 | P45974 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 2/20 | 0.38 |
| ▸ | PPARA | Q07869 | 2/20 | 0.38 |
| ▸ | PGR | P06401 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10799733 | 0.85 | MAPT (0.47) | MAPTSMN1; SMN2L3MBTL1USP5ABCB1 | |
| SCHEMBL3404341 | 0.83 | USP5 (0.63) | MAPTSMN1; SMN2L3MBTL1USP5POLB | |
| Methane SCHEMBL28686261 | 0.82 | USP5 (0.61) | MAPTSMN1; SMN2L3MBTL1USP5POLB | |
| Hydrochloric Acid SCHEMBL28093688 | 0.82 | USP5 (0.61) | MAPTSMN1; SMN2L3MBTL1USP5POLB | |
| SCHEMBL8252944 | 0.80 | MAPT (0.50) | MAPTSMN1; SMN2L3MBTL1USP5ABCB1 | |
| SCHEMBL17049803 | 0.80 | SMN1; SMN2 (0.50) | MAPTSMN1; SMN2L3MBTL1USP5ABCB1 | |
| Butane SCHEMBL10985150 | 0.80 | USP5 (0.59) | MAPTSMN1; SMN2L3MBTL1USP5ABCB1 | |
| SCHEMBL13144196 | 0.80 | SMN1; SMN2 (0.50) | MAPTSMN1; SMN2L3MBTL1USP5ABCB1 | |
| SCHEMBL2274688 | 0.80 | MAPT (0.50) | MAPTSMN1; SMN2L3MBTL1USP5ABCB1 | |
| SCHEMBL8051337 | 0.80 | SMN1; SMN2 (0.70) | MAPTSMN1; SMN2L3MBTL1ATMGSK3B |
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 |
|---|---|---|---|---|---|---|---|
| CN-105377846-A | Organic compounds | INTRA CELLULAR THERAPIES INC | 2016-03-02 | — | — | CN | disclosed |
| CN-105143229-A | Substituted xanthines and methods of use thereof | HYDRA BIOSCIENCES INC | 2015-12-09 | — | — | CN | disclosed |
| CN-105121423-A | Novel 3- (4- (benzyloxy) phenyl) hex-4-ynoic acid derivative, method for preparing the same, and pharmaceutical composition for preventing and treating metabolic diseases comprising the same as an effective ingredient | HYUNDAI PHARM CO LTD | 2015-12-02 | — | — | CN | disclosed |