Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.32 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.31 |
| ▸ | GABRA2 | P47869 | 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 | |
|---|---|---|---|---|
| SCHEMBL21397469 | 0.91 | DPP4 (0.37) | DPP4NR3C2DPP8DPP9GABRA1 | |
| SCHEMBL23046130 | 0.81 | NPY5R (0.36) | DPP4NR3C2USP2CYP2D6ALOX15 | |
| SCHEMBL29891089 | 0.81 | NPY5R (0.36) | DPP4NR3C2USP2CYP2D6ALOX15 | |
| SCHEMBL29891133 | 0.75 | RORC (0.37) | DPP4DPP8DPP9KDM1AHTR2A | |
| SCHEMBL23046128 | 0.75 | RORC (0.37) | DPP4DPP8DPP9KDM1AHTR2A | |
| SCHEMBL28513992 | 0.75 | DPP4 (0.38) | DPP4USP2CYP2D6ALOX15DPP8 | |
| SCHEMBL21384094 | 0.71 | DPP4 (0.40) | DPP4USP2CYP2D6ALOX15CHRNB2 | |
| SCHEMBL21384063 | 0.71 | DPP4 (0.40) | DPP4MAPK1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL23046174 | 0.71 | DPP4 (0.40) | DPP4MAPK1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL30529384 | 0.71 | DPP4 (0.40) | DPP4MAPK1CHRNB2CHRNB4CHRNA3 |
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-2019183367-A1 | SHP2 PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF | RELAY THERAPEUTICS, INC. (US) | 2019-09-26 | — | — | WO | disclosed |