Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 2/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | F10 | P00742 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3307690 | 0.86 | ADRB1 (0.67) | ADRB1L3MBTL1KDM4EALDH1A1MEN1 | |
| SCHEMBL17281442 | 0.86 | ADRB1 (0.67) | ADRB1L3MBTL1KDM4EALDH1A1MEN1 | |
| SCHEMBL30228382 | 0.84 | SLC6A2 (0.51) | ADRB1KDM4EALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL1803475 | 0.84 | ADRB1 (0.65) | ADRB1L3MBTL1KDM4EALDH1A1MEN1 | |
| SCHEMBL12991 | 0.84 | ADRB1 (0.69) | ADRB1L3MBTL1KDM4EALDH1A1MEN1 | |
| SCHEMBL11510734 | 0.82 | SLC6A2 (0.52) | ADRB1KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL8264176 | 0.80 | ADRB1 (0.69) | ADRB1L3MBTL1KDM4EALDH1A1MEN1 | |
| SCHEMBL3035322 | 0.79 | ADRB1 (0.69) | ADRB1KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL30180110 | 0.79 | ADRB1 (0.69) | ADRB1KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL4630330 | 0.79 | ALDH1A1 (0.59) | L3MBTL1KDM4EALDH1A1MEN1KMT2A |
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-2021019514-A1 | HETEROCYCLIC COMPOUNDS AS KINASE INHIBITOR AND USES THEREOF | INTEGRAL BIOSCIENCES PVT. LTD. (IN) | 2021-02-04 | — | — | WO | disclosed |