Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 15/20 | 0.70 |
| ▸ | ESRRG | P62508 | 12/20 | 0.67 |
| ▸ | ESRRB | O95718 | 6/20 | 0.67 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.67 |
| ▸ | MAPT | P10636 | 3/20 | 0.67 |
| ▸ | MEN1 | O00255 | 2/20 | 0.67 |
| ▸ | TP53 | P04637 | 2/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.67 |
| ▸ | PGR | P06401 | 2/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.67 |
| ▸ | LMNA | P02545 | 1/20 | 0.67 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.67 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.67 |
| ▸ | PLD2 | O14939 | 1/20 | 0.67 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.67 |
| ▸ | ESRRA | P11474 | 3/20 | 0.62 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL10484358 | 1.00 | ESR1 (0.70) | ESR1ESRRGESRRBESR2MAPT | |
| SCHEMBL1151837 | 1.00 | ESR1 (0.70) | ESR1ESRRGESRRBESR2MAPT | |
| SCHEMBL10484026 | 1.00 | ESR1 (0.70) | ESR1ESRRGESRRBESR2MAPT | |
| Hydrochloric Acid SCHEMBL10484008 | 0.99 | ESR1 (0.68) | ESR1ESRRGESRRBESR2MAPT | |
| Hydrochloric Acid SCHEMBL10484012 | 0.99 | ESR1 (0.68) | ESR1ESRRGESRRBESR2MAPT | |
| SCHEMBL1152006 | 0.95 | ESR1 (0.61) | ESR1ESRRGESRRBESR2MAPT | |
| SCHEMBL1152003 | 0.95 | ESR1 (0.61) | ESR1ESRRGESRRBESR2MAPT | |
| SCHEMBL10484027 | 0.95 | ESR1 (0.64) | ESR1ESRRGESRRBESR2MAPT | |
| SCHEMBL10484033 | 0.95 | ESR1 (0.64) | ESR1ESRRGESRRBESR2MAPT | |
| SCHEMBL10484030 | 0.95 | ESR1 (0.64) | ESR1ESRRGESRRBESR2MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008133884-A2 | METHODS AND COMPOSITIONS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS | COMBINATORX, INCORPORATED (US) | 2008-11-06 | — | — | WO | disclosed |
| US-4806685-A | EXERTS VARIOUS EFFECTS ON ENDOCRINOUS SYSTEM OF RATS; INHIBITS GROWTH OF MAMMARY TUMORS | GYOGYSZERKUTATO INTEEZET/PHARMACEUTICAL RESEARCH INSTITUTE (HU) | 1989-02-21 | — | — | US | disclosed |