Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 2/20 | 0.53 |
| ▸ | HTR2B | P41595 | 1/20 | 0.53 |
| ▸ | CTSC | P53634 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ELANE | P08246 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 2/20 | 0.39 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ANPEP | P15144 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | SCN4A | P35499 | 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 | |
|---|---|---|---|---|
| SCHEMBL693351 | 0.85 | TSHR (0.63) | HTR2CHTR2BCTSCTSHRELANE | |
| SCHEMBL4069956 | 0.85 | TSHR (0.63) | HTR2CHTR2BCTSCTSHRELANE | |
| SCHEMBL630517 | 0.85 | TSHR (0.63) | HTR2CHTR2BCTSCTSHRELANE | |
| SCHEMBL7422921 | 0.84 | SLC6A2 (0.46) | HTR2CHTR2BCTSCKCNH2 | |
| Hydrochloric Acid SCHEMBL1000787 | 0.84 | TSHR (0.65) | HTR2CHTR2BCTSCTSHRELANE | |
| Hydrochloric Acid SCHEMBL693350 | 0.84 | TSHR (0.65) | HTR2CHTR2BCTSCTSHRELANE | |
| Hydrochloric Acid SCHEMBL630516 | 0.84 | TSHR (0.65) | HTR2CHTR2BCTSCTSHRELANE | |
| SCHEMBL630942 | 0.81 | TSHR (0.61) | HTR2CHTR2BTSHRPOLBGLA | |
| SCHEMBL6727374 | 0.81 | TSHR (0.61) | HTR2CHTR2BTSHRPOLBGLA | |
| SCHEMBL3447413 | 0.81 | TSHR (0.51) | HTR2CHTR2BCTSCTSHRELANE |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012048013-A2 | PHOSPHORODIAMIDATE DERIVATIVES OF GUANOSINE NUCLEOSIDE COMPOUNDS FOR TREATMENT OF VIRAL INJECTIONS | INHIBITEX, INC. (US) | 2012-04-12 | — | — | WO | disclosed |
| EP-0439444-A2 | Synthesis of chiral pyrrolidine and piperidine glycosidase inhibitors | MONSANTO COMPANY (US) | 1991-07-31 | — | — | EP | disclosed |
| US-5013842-A | Synthesis of chiral pyrrolidine and piperidine glycosidase inhibitors | MONSANTO COMPANY (US) | 1991-05-07 | — | — | US | disclosed |