Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 4/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | PDGFRB | P09619 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3533825 | 0.88 | PDGFRB (0.50) | KDRHTTALDH1A1LMNAKMT2A | |
| SCHEMBL3529825 | 0.81 | HSP90AB1 (0.53) | KDRALDH1A1LMNAKMT2APDGFRB | |
| SCHEMBL3529823 | 0.80 | ALDH1A1 (0.50) | ALDH1A1LMNAKMT2APDGFRBKDM4E | |
| SCHEMBL3531360 | 0.73 | HSP90AB1 (0.47) | KDRHTTALDH1A1LMNAPDGFRB | |
| SCHEMBL10207563 | 0.73 | ALDH1A1 (0.48) | ALDH1A1LMNAKMT2AKDM4ENPC1 | |
| SCHEMBL12204214 | 0.72 | ALDH1A1 (0.57) | HTTALDH1A1LMNAKMT2ANPC1 | |
| SCHEMBL3533372 | 0.69 | HSP90AB1 (0.47) | KDRHTTLMNAPDGFRBKDM4E | |
| SCHEMBL3532057 | 0.69 | LMNA (0.44) | KDRHTTLMNAPDGFRBMAPT | |
| SCHEMBL3531179 | 0.69 | PDGFRB (0.46) | KDRHTTALDH1A1LMNAPDGFRB | |
| SCHEMBL3530952 | 0.68 | NPC1 (0.51) | KDRKMT2APDGFRBNPC1MAPT |
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-7662828-B2 | Substituted 5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine-2-yl compounds and 5,6,7,8-tetrahydroquinazoline-2-yl compounds | GRUENENTHAL GMBH (DE) | 2010-02-16 | — | — | US | claimed |