Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | MAT2A | P31153 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8067651 | 0.90 | ALDH1A1 (0.51) | ALDH1A1HPGDMAPTKDM4EATM | |
| SCHEMBL7032311 | 0.85 | KMT2A (0.39) | ALDH1A1MAT2AMAPTSMN1; SMN2 | |
| SCHEMBL8069213 | 0.84 | ALDH1A1 (0.41) | ALDH1A1MAT2AHPGDMAPTKDM4E | |
| SCHEMBL8390915 | 0.81 | PTGS2 (0.37) | ALDH1A1MAT2AHPGDKDM4ESMN1; SMN2 | |
| SCHEMBL12752207 | 0.81 | KMT2A (0.35) | ALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL12752333 | 0.78 | KMT2A (0.35) | ALDH1A1HPGDKDM4EATMHSD17B10 | |
| SCHEMBL12752218 | 0.78 | MEN1 (0.33) | HTT | |
| SCHEMBL12752380 | 0.78 | RAB9A (0.32) | KDM4E | |
| Emivirine SCHEMBL140546 | 0.77 | ALDH1A1 (0.43) | ALDH1A1HPGDMAPTKDM4EPOLB | |
| Emivirine SCHEMBL4657810 | 0.77 | ALDH1A1 (0.43) | ALDH1A1HPGDMAPTKDM4EPOLB |
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-6136815-A | VIRICIDES FOR TREATMENT OF AIDS | KOREA RESEARCH INST. OF CHEM. TECH. (KR) | 2000-10-24 | — | — | US | disclosed |