Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | MAP3K14 | Q99558 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | HTR6 | P50406 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | TDO2 | P48775 | 1/20 | 0.32 |
| ▸ | ICMT | O60725 | 1/20 | 0.31 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.31 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.31 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28719542 | 0.83 | TSHR (0.43) | TSHRKDM1ARCOR1PSEN1PSEN2 | |
| SCHEMBL4599737 | 0.82 | OPRM1 (0.40) | HDAC4MEN1KMT2AOPRM1OPRK1 | |
| SCHEMBL23532453 | 0.66 | CHRNB2 (0.39) | TACR1TSHRMAP3K14SLC6A4SLC6A3 | |
| SCHEMBL22436670 | 0.62 | OPRM1 (0.42) | MEN1KMT2AOPRM1OPRK1OPRL1 | |
| SCHEMBL24177590 | 0.61 | SMN1; SMN2 (0.39) | TSHRSLC6A4SLC6A3MEN1MAPT | |
| 1,3,5-Trichlorobenzene SCHEMBL27328470 | 0.59 | CA12 (0.65) | TSHRMEN1MAPTRAB9AKMT2A | |
| SCHEMBL308200 | 0.59 | CYP1A2 (0.60) | TSHRSLC6A4SLC6A3MEN1RAB9A | |
| Chlorobenzene SCHEMBL11493758 | 0.58 | TSHR (0.73) | TSHRMEN1MAPTRAB9AKMT2A | |
| SCHEMBL6426369 | 0.58 | MAOB (0.46) | HDAC4OPRM1OPRK1OPRL1 | |
| SCHEMBL1610186 | 0.58 | OPRM1 (0.42) | HDAC4OPRM1OPRK1OPRL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993015100-A1 | NOVEL ADENOSINE DERIVATIVES, THEIR PREPARATION METHODS AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | LABORATOIRES UPSA (FR) | 1993-08-05 | — | — | WO | disclosed |