Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 6/20 | 0.55 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.55 |
| ▸ | LMNA | P02545 | 4/20 | 0.51 |
| ▸ | PSD | A5PKW4 | 1/20 | 0.50 |
| ▸ | TTR | P02766 | 1/20 | 0.46 |
| ▸ | FPR1 | P21462 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMPD1 | P17405 | 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 | |
|---|---|---|---|---|
| SCHEMBL2330593 | 0.84 | ESR1 (0.58) | ESR1ESR2LMNAPSDTTR | |
| SCHEMBL17491756 | 0.82 | ESR1 (0.58) | ESR1ESR2LMNAPSDTTR | |
| SCHEMBL2329035 | 0.80 | ESR1 (0.54) | ESR1ESR2LMNAPSDTTR | |
| SCHEMBL2329177 | 0.76 | ESR1 (0.65) | ESR1ESR2LMNAPSDTTR | |
| SCHEMBL10815457 | 0.74 | ESR1 (0.81) | ESR1ESR2LMNAPSDTTR | |
| SCHEMBL2182106 | 0.73 | ESR1 (0.90) | ESR1ESR2LMNAPSDTTR | |
| SCHEMBL2337131 | 0.73 | ESR1 (0.57) | ESR1ESR2LMNAPSDTTR | |
| SCHEMBL2334656 | 0.72 | ESR1 (0.77) | ESR1ESR2LMNAPSDTTR | |
| SCHEMBL3957035 | 0.71 | ESR1 (1.00) | ESR1ESR2LMNAPSDTTR | |
| SCHEMBL2337411 | 0.70 | ESR1 (0.58) | ESR1ESR2LMNAPSDTTR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2533638-B1 | NOVEL S-NITROSOGLUTATHIONE REDUCTASE INHIBITORS | NIVALIS THERAPEUTICS INC (US) | 2016-02-10 | — | — | EP | claimed |