Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.63 |
| ▸ | XDH | P47989 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | POLA1 | P09884 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL37384 | 0.98 | DPP4 (0.66) | DPP4XDHKDM4EPDPK1GDA | |
| Hydrochloric Acid SCHEMBL4763244 | 0.96 | DPP4 (0.63) | DPP4XDHKDM4EPDPK1GDA | |
| SCHEMBL8719273 | 0.96 | DPP4 (0.63) | DPP4XDHKDM4EPDPK1GDA | |
| Alcohol SCHEMBL27897029 | 0.87 | DPP4 (0.54) | DPP4XDHKDM4ESMN1; SMN2TMIGD3 | |
| Purine SCHEMBL10869621 | 0.81 | KDM4E (0.50) | DPP4XDHKDM4ESMN1; SMN2TMIGD3 | |
| Tetrabuthylammonium SCHEMBL3029323 | 0.79 | POLA1 (0.48) | DPP4XDHADORA3POLA1 | |
| SCHEMBL24500763 | 0.78 | XDH (0.56) | DPP4XDHKDM4EPDPK1GDA | |
| SCHEMBL3002433 | 0.78 | DPP4 (0.61) | DPP4XDHPDPK1GDAADORA3 | |
| SCHEMBL356178 | 0.78 | DPP4 (0.61) | DPP4XDHKDM4EPDPK1GDA | |
| 6-Chloroguanine SCHEMBL64059 | 0.78 | DPP4 (1.00) | DPP4PDPK1GDA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4201860-A | BRONCHODILATORS | BRISTOL-MYERS COMPANY (US) | 1980-05-06 | — | — | US | disclosed |
| US-4172829-A | 2,9-Disubstituted adenine derivatives and their use as non-adrenergic bronchodilators | BRISTOL-MYERS COMPANY (US) | 1979-10-30 | — | — | US | disclosed |