Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 6/20 | 0.56 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.53 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.53 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.53 |
| ▸ | DRD1 | P21728 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | TOP2A | P11388 | 4/20 | 0.44 |
| ▸ | TOP2B | Q02880 | 4/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Water SCHEMBL8942213 | 0.99 | DPP4 (0.55) | DPP4CHRM2ALDH1A1POLBCHRM1 | |
| SCHEMBL8941979 | 0.89 | DPP4 (0.50) | DPP4CHRM2ALDH1A1POLBCHRM1 | |
| SCHEMBL8941950 | 0.88 | ADRB2 (0.44) | DPP4CHRM2ALDH1A1POLBCHRM1 | |
| SCHEMBL8942245 | 0.86 | DPP4 (0.49) | DPP4CHRM2ALDH1A1POLBCHRM1 | |
| SCHEMBL9775925 | 0.86 | TOP2A (0.56) | DPP4CHRM2ALDH1A1POLBCHRM1 | |
| SCHEMBL9775873 | 0.86 | KDM4E (0.52) | DPP4CHRM2ALDH1A1POLBCHRM1 | |
| SCHEMBL8942316 | 0.86 | ALDH1A1 (0.50) | DPP4CHRM2ALDH1A1POLBCHRM1 | |
| SCHEMBL8942390 | 0.86 | DPP4 (0.47) | DPP4CHRM2ALDH1A1POLBCHRM1 | |
| SCHEMBL8942227 | 0.85 | DPP4 (0.47) | DPP4CHRM2ALDH1A1POLBCHRM1 | |
| SCHEMBL6609141 | 0.85 | DPP4 (0.54) | DPP4CHRM2ALDH1A1DRD1CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-5556861-A | 1,8 benzonaphthyridine derivatives and antimicrobial compositions | LABORATOIRE ROGER BELLON (FR) | 1996-09-17 | — | — | US | disclosed |