Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.47 |
| ▸ | ESR1 | P03372 | 7/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11547399 | 0.95 | MAOB (0.44) | SLC22A12ESR1KDM4EMAPTALOX15 | |
| SCHEMBL11547403 | 0.94 | ESR1 (0.43) | SLC22A12ESR1ESR2KDM4EMAPT | |
| SCHEMBL11547297 | 0.92 | ESR1 (0.46) | SLC22A12ESR1ESR2ABCG2 | |
| SCHEMBL11547893 | 0.91 | SLC22A12 (0.46) | SLC22A12ESR1ESR2KDM4EMAPT | |
| SCHEMBL11552701 | 0.90 | ESR1 (0.47) | SLC22A12ESR1ESR2ALDH2TSHR | |
| SCHEMBL11551820 | 0.89 | MAOB (0.41) | SLC22A12ESR1KDM4EMAPTMAOB | |
| SCHEMBL11553668 | 0.88 | MAPK1 (0.45) | SLC22A12ESR1ESR2KDM4EMAOB | |
| SCHEMBL11547983 | 0.87 | SLC22A12 (0.43) | SLC22A12ESR1ESR2KDM4EMAPT | |
| SCHEMBL11556350 | 0.87 | HPGD (0.46) | SLC22A12ESR1ESR2KDM4EMAPT | |
| SCHEMBL11549202 | 0.87 | ALDH1A1 (0.48) | SLC22A12KDM4EMAPTTSHRMAPK1 |
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-4133814-A | ANTITUMOR AGENTS | ELI LILLY AND COMPANY (US) | 1979-01-09 | — | — | US | disclosed |