Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 2/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 2/20 | 0.36 |
| ▸ | HRH2 | P25021 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL8634429 | 1.00 | NOS1 (0.38) | NOS1HSP90AA1HSP90AB1LMNAPOLB | |
| SCHEMBL8634425 | 1.00 | NOS1 (0.38) | NOS1HSP90AA1HSP90AB1LMNAPOLB | |
| SCHEMBL8634423 | 1.00 | NOS1 (0.38) | NOS1HSP90AA1HSP90AB1LMNAPOLB | |
| SCHEMBL8636193 | 1.00 | NOS1 (0.38) | NOS1HSP90AA1HSP90AB1LMNAPOLB | |
| SCHEMBL8633476 | 0.82 | NOS1 (0.36) | NOS1HSP90AA1HSP90AB1LMNAPOLB | |
| SCHEMBL512167 | 0.75 | HRH2 (0.32) | HRH2HRH3 | |
| SCHEMBL1225635 | 0.71 | HRH2 (0.34) | HRH2HRH3 | |
| SCHEMBL8634146 | 0.70 | HSP90AA1 (0.40) | NOS1HSP90AA1HSP90AB1HRH3 | |
| SCHEMBL8634448 | 0.68 | LMNA (0.54) | LMNAPOLBGAAMAPTTSHR | |
| SCHEMBL513286 | 0.67 | HRH3 (0.41) | NOS1DHFRHRH2HRH3 |
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-5712281-A | Insecticidal substituted-2,4-diamino-5,6,7,8-tetrahydroquinazolines | FMC CORPORATION (US) | 1998-01-27 | — | — | US | disclosed |
| US-5536725-A | Insecticidal substituted-2,4-diamino-5,6,7,8-tetrahydroquinazolines | FMC CORPORATION (US) | 1996-07-16 | — | — | US | disclosed |