Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.53 |
| ▸ | MAOB | P27338 | 2/20 | 0.53 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.46 |
| ▸ | ESR1 | P03372 | 2/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.44 |
| ▸ | MIF | P14174 | 2/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.43 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.43 |
| ▸ | TUBB | P07437 | 1/20 | 0.43 |
| ▸ | YES1 | P07947 | 1/20 | 0.43 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.43 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.43 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.43 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.43 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.43 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.43 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.43 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.43 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1500283 | 0.81 | MAOA (0.51) | MAOAMAOBESR2ESR1ALOX12 | |
| SCHEMBL5797926 | 0.78 | ALOX12 (0.75) | MAOAMAOBESR2ESR1ALOX12 | |
| SCHEMBL131543 | 0.78 | ALOX12 (0.75) | MAOAMAOBESR2ESR1ALOX12 | |
| SCHEMBL16152440 | 0.78 | ALOX12 (0.75) | MAOAMAOBESR2ESR1ALOX12 | |
| SCHEMBL68086 | 0.78 | CYP19A1 (0.59) | MAOBCYP19A1 | |
| SCHEMBL7241604 | 0.78 | CYP19A1 (0.59) | MAOBCYP19A1 | |
| SCHEMBL23882822 | 0.77 | MAOB (0.51) | MAOAMAOBESR2ESR1ALOX12 | |
| SCHEMBL5239429 | 0.76 | PTPN1 (0.56) | MAOAMAOBESR2ESR1ALOX12 | |
| SCHEMBL10685626 | 0.76 | CYP19A1 (0.69) | MAOAMAOBALOX12CYP19A1PSMB5 | |
| SCHEMBL31290567 | 0.76 | PTPN1 (0.56) | MAOAMAOBALOX12PTPN1MIF |
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-112442004-A | Icaritin analogue and preparation method and application thereof | 中国药科大学 | 2021-03-05 | — | — | CN | disclosed |