Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 7/20 | 0.73 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 3/20 | 0.38 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.36 |
| ▸ | TUBB | P07437 | 1/20 | 0.36 |
| ▸ | YES1 | P07947 | 1/20 | 0.36 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.36 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.36 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.36 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.36 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.36 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.36 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.36 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.36 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.36 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28509512 | 0.76 | CYP19A1 (0.68) | ESR2CYP19A1MAPTLMNAPKM | |
| SCHEMBL28114452 | 0.75 | ESR2 (0.46) | ESR2MAPTLMNAALDH1A1BRD4 | |
| SCHEMBL6281933 | 0.75 | BRD4 (0.44) | ESR2CYP19A1LMNAMEN1KMT2A | |
| SCHEMBL4621828 | 0.72 | ESR2 (0.43) | ESR2CYP19A1MAPTLMNAALOX12 | |
| SCHEMBL7212449 | 0.71 | ESR2 (0.42) | ESR2LMNAALDH1A1MEN1KMT2A | |
| SCHEMBL5668502 | 0.70 | DDB1 (0.50) | ESR2CYP19A1ESR1MAPTALDH1A1 | |
| SCHEMBL7346196 | 0.70 | ESR2 (0.41) | ESR2MAPTLMNAALDH1A1BRD4 | |
| SCHEMBL6252884 | 0.69 | BRD4 (0.47) | CYP19A1MAPTLMNAALOX12ALDH1A1 | |
| SCHEMBL2030055 | 0.69 | ESR2 (0.51) | ESR2CYP19A1ESR1TTRMAPT | |
| SCHEMBL17049187 | 0.68 | KDM4E (0.50) | ESR2MAPTLMNAALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-101147737-A | Selective estrogenic receptor subtype regulator and its synthesizing method and medical use | SHANGHAI INST MATERIA MEDICA (CN) | 2008-03-26 | — | — | CN | disclosed |