Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.50 |
| ▸ | HTR2C | P28335 | 10/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 3/20 | 0.38 |
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | QDPR | P09417 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RAD52 | P43351 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28675583 | 0.73 | RECQL (0.31) | — | |
| SCHEMBL415545 | 0.69 | SIGMAR1 (1.00) | SIGMAR1HTR2CKDM4EALDH1A1MAPT | |
| Bromide SCHEMBL11385943 | 0.67 | SIGMAR1 (0.96) | SIGMAR1HTR2CKDM4EALDH1A1MAPT | |
| Hydrochloric Acid SCHEMBL446973 | 0.67 | HTR2C (1.00) | SIGMAR1HTR2CKDM4EALDH1A1MAPT | |
| SCHEMBL3899585 | 0.66 | SIGMAR1 (0.92) | SIGMAR1HTR2CKDM4EALDH1A1MAPT | |
| Hydrochloric Acid SCHEMBL3676212 | 0.66 | SIGMAR1 (0.92) | SIGMAR1HTR2CKDM4EALDH1A1MAPT | |
| SCHEMBL23937172 | 0.65 | — | — | |
| SCHEMBL4479260 | 0.64 | MAOB (0.34) | HTR2CKDM4EMAPTHSD17B10 | |
| SCHEMBL24316682 | 0.64 | RECQL (0.32) | HTR2CHSD17B10 | |
| SCHEMBL12087540 | 0.64 | HDAC4 (0.34) | HTR2CKDM4EMAPTHSD17B10 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3519387-B1 | TETRAHYDROPYRIDINE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS | DONG A ST CO LTD (KR) | 2021-08-11 | — | — | EP | disclosed |