Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.41 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.41 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16978651 | 0.86 | DDB1 (0.44) | ALDH1A1HPGDGAAHSD17B10KMT2A | |
| SCHEMBL4939209 | 0.85 | ALDH1A1 (0.43) | ALDH1A1HPGDGAAKMT2AMEN1 | |
| SCHEMBL16978678 | 0.84 | PARP1 (0.46) | ALDH1A1HPGDGAAHSD17B10KMT2A | |
| SCHEMBL4478189 | 0.79 | LMNA (0.46) | ALDH1A1GAAKMT2AMEN1TSHR | |
| SCHEMBL4484069 | 0.79 | MEN1 (0.48) | ALDH1A1KMT2AMEN1MAPK1LMNA | |
| SCHEMBL16007931 | 0.78 | BRD4 (0.48) | ALDH1A1HPGDGAAKMT2AMEN1 | |
| SCHEMBL4488507 | 0.76 | AKR1B1 (0.47) | ALDH1A1HPGDKMT2AMEN1MAPK1 | |
| SCHEMBL4484368 | 0.75 | MEN1 (0.39) | ALDH1A1KMT2AMEN1LMNABRD4 | |
| SCHEMBL18920023 | 0.74 | ALDH1A1 (0.41) | ALDH1A1KMT2AMEN1CASP3LMNA | |
| SCHEMBL4494967 | 0.73 | POLB (0.46) | ALDH1A1HPGDKMT2AMEN1MAPK1 |
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-20150218164-A1 | SUBSTITUTED NAPHTHYRIDINEDIONE DERIVATIVES AS HIV INTEGRASE INHIBITORS | MERCK SHARP & DOHME CORP. | 2015-08-06 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20150218164-A1 | SUBSTITUTED NAPHTHYRIDINEDIONE DERIVATIVES AS HIV INTEGRASE INHIBITORS | SAMHD1, ENTPD5, DUT | ALDH1A1 1014/4885HPGD 259/4885GAA 442/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.