Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | F10 | P00742 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | IDH1 | O75874 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL25482879 | 0.92 | NPC1 (0.52) | NPC1SMN1; SMN2HTTRAB9AKMT2A | |
| SCHEMBL23840307 | 0.76 | EGFR (0.44) | SMN1; SMN2HTTKMT2AMEN1L3MBTL1 | |
| SCHEMBL23840608 | 0.76 | IDH1 (0.42) | NPC1SMN1; SMN2HTTRAB9AKMT2A | |
| SCHEMBL23840621 | 0.75 | MEN1 (0.52) | NPC1SMN1; SMN2HTTRAB9AKMT2A | |
| SCHEMBL23840604 | 0.75 | ITGA1 (0.45) | SMN1; SMN2HTTKMT2AMEN1ALDH1A1 | |
| SCHEMBL23840640 | 0.74 | BRD4 (0.49) | IDH1 | |
| SCHEMBL23840609 | 0.73 | SMN1; SMN2 (0.40) | SMN1; SMN2KMT2AMEN1L3MBTL1ALDH1A1 | |
| SCHEMBL23840603 | 0.73 | ALDH1A1 (0.46) | NPC1SMN1; SMN2RAB9AKMT2AMEN1 | |
| SCHEMBL23833491 | 0.72 | EGFR (0.51) | SMN1; SMN2HTTKMT2AMEN1IDH1 | |
| SCHEMBL30151007 | 0.72 | EGFR (0.51) | SMN1; SMN2HTTKMT2AMEN1IDH1 |
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-2021188907-A1 | PYRIDINESULFONAMIDE DERIVATIVES AS TRAP1 MODULATORS AND USES THEREOF | AMATHUS THERAPEUTICS, INC. (US) | 2021-09-23 | — | — | WO | disclosed |