Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 3/20 | 0.33 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.33 |
| ▸ | CDK9 | P50750 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.31 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.31 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 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 | |
|---|---|---|---|---|
| SCHEMBL28905313 | 0.92 | DPP4 (0.38) | DPP4ACHECCNE1CDK2CCNT1 | |
| SCHEMBL28511456 | 0.84 | DPP9 (0.34) | ACHEBCHECYP2D6SSTR4DPP8 | |
| SCHEMBL28500011 | 0.78 | CHRNB2 (0.32) | CCNE1CDK2 | |
| SCHEMBL23046130 | 0.77 | NPY5R (0.36) | DPP4USP2CYP2D6ALOX15DPP8 | |
| SCHEMBL29891089 | 0.77 | NPY5R (0.36) | DPP4USP2CYP2D6ALOX15DPP8 | |
| SCHEMBL21397429 | 0.75 | DPP4 (0.37) | DPP4USP2CYP2D6ALOX15ALDH1A1 | |
| SCHEMBL21384094 | 0.71 | DPP4 (0.40) | DPP4USP2CYP2D6ALOX15ALDH1A1 | |
| SCHEMBL29891133 | 0.70 | RORC (0.37) | DPP4DPP8DPP9 | |
| SCHEMBL23046128 | 0.70 | RORC (0.37) | DPP4DPP8DPP9 | |
| Trifluoroacetic Acid SCHEMBL21855805 | 0.69 | KDM1A (0.33) | DPP4USP2CYP2D6ALOX15ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117263942-A | SHP2 phosphatase inhibitors and methods of use thereof | 传达治疗有限公司 | 2023-12-22 | — | — | CN | disclosed |
| CN-112166110-B | SHP2 phosphatase inhibitors and methods of use thereof | 传达治疗有限公司 | 2023-08-11 | — | — | CN | disclosed |
| CN-112166110-A | SHP2 phosphatase inhibitors and methods of use thereof | 传达治疗有限公司 | 2021-01-01 | — | — | CN | disclosed |