Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | DHFR | P00374 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL10734167 | 0.81 | KDR (0.51) | KDRMAPTALDH1A1HTTDHFR | |
| SCHEMBL10737344 | 0.81 | KDR (0.54) | KDRMAPTALDH1A1DHFRTP53 | |
| SCHEMBL10733928 | 0.76 | PDE7A (0.49) | MAPTALDH1A1HTTNPSR1SMN1; SMN2 | |
| SCHEMBL10744234 | 0.76 | PDE7A (0.49) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL15798525 | 0.74 | ALDH1A1 (0.58) | KDRMAPTALDH1A1HTTNPSR1 | |
| SCHEMBL10741952 | 0.73 | PDE7A (0.44) | ALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL28440551 | 0.73 | ALDH1A1 (0.56) | KDRMAPTALDH1A1HTTCYP3A4 | |
| SCHEMBL4956032 | 0.71 | CYP1A2 (0.59) | KDRMAPTALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL23070048 | 0.70 | ALDH1A1 (0.47) | KDRMAPTALDH1A1HTTNPC1 | |
| SCHEMBL29959860 | 0.70 | ALDH1A1 (0.47) | KDRMAPTALDH1A1HTTNPC1 |
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-4652558-A | FUNGICIDES, INSECTICIDES | CHEVRON RESEARCH COMPANY (US) | 1987-03-24 | — | — | US | disclosed |