Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | GPR3 | P46089 | 4/20 | 0.35 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.33 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3953219 | 0.83 | HPRT1 (0.37) | ALDH1A1TSHRHPRT1KDM4EGAA | |
| SCHEMBL2648160 | 0.83 | ALDH1A1 (0.52) | ALDH1A1HSD17B10TDP1TSHRIDO1 | |
| SCHEMBL7837636 | 0.83 | — | — | |
| SCHEMBL7837650 | 0.83 | IDO1 (0.68) | HSD17B10TDP1TSHRCYP1A2IDO1 | |
| SCHEMBL2860159 | 0.83 | CYP1A2 (0.68) | ALDH1A1HSD17B10CYP2A6TDP1TSHR | |
| SCHEMBL3946391 | 0.83 | RXFP1 (0.39) | ALDH1A1CYP1A2KDM4ESMN1; SMN2MEN1 | |
| SCHEMBL5437391 | 0.83 | CYP2A6 (0.68) | ALDH1A1HSD17B10CYP2A6TDP1TSHR | |
| SCHEMBL6312117 | 0.81 | PARP1 (0.39) | ALDH1A1HSD17B10CYP2A6KDM4EMAPK1 | |
| SCHEMBL7833168 | 0.79 | GABRA1 (0.39) | TSHRCYP1A2HIF1AHPGD | |
| SCHEMBL7212039 | 0.77 | CHEK1 (0.57) | ALDH1A1TDP1TSHRCYP1A2KDM4E |
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-3947511-A | RUBBER CURING AGENTS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-03-30 | — | — | US | disclosed |