Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 3/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | HTR2B | P41595 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | KCNA4 | P22459 | 1/20 | 0.38 |
| ▸ | KCNA1 | Q09470 | 1/20 | 0.38 |
| ▸ | KCNAB1 | Q14722 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 8/20 | 0.36 |
| ▸ | MAOB | P27338 | 8/20 | 0.36 |
| ▸ | KDM1A | O60341 | 6/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8845605 | 1.00 | HTR2C (0.41) | HTR2CHTR2AHTR2BALDH1A1TDP1 | |
| SCHEMBL22394664 | 0.74 | SLC9A1 (0.41) | ALDH1A1KCNA4KCNA1KCNAB1CYP2C19 | |
| SCHEMBL22394666 | 0.74 | SLC9A1 (0.41) | ALDH1A1KCNA4KCNA1KCNAB1CYP2C19 | |
| SCHEMBL7438967 | 0.74 | HTR2A (0.41) | HTR2CHTR2AHTR2BALDH1A1KCNA4 | |
| SCHEMBL7438962 | 0.74 | HTR2A (0.41) | HTR2CHTR2AHTR2BALDH1A1KCNA4 | |
| SCHEMBL4324752 | 0.72 | ALDH1A1 (0.43) | ALDH1A1TDP1TSHRMAOAMAOB | |
| SCHEMBL13834832 | 0.71 | HTR2A (0.58) | HTR2CHTR2AHTR2BTSHRMAOA | |
| SCHEMBL19730905 | 0.71 | HTR2A (0.58) | HTR2CHTR2AHTR2BTSHRMAOA | |
| SCHEMBL8914129 | 0.71 | HTR2A (0.41) | HTR2CHTR2AHTR2BALDH1A1TSHR | |
| SCHEMBL19730903 | 0.71 | HTR2A (0.58) | HTR2CHTR2AHTR2BTSHRMAOA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023142725-A1 | CYCLOPROPANE SKELETON MONOPHOSPHINE LIGAND AND PALLADIUM COMPLEX THEREOF AS WELL AS PREPARATION METHOD AND USE THEREOF | 南开大学 | 2023-08-03 | — | — | WO | disclosed |
| US-5658914-A | ANTIESTROGENS, ANTITUMOR AGENTS | RESEARCH CORPORATION TECHNOLOGIES (US) | 1997-08-19 | — | — | US | disclosed |
| US-5658951-A | ANTIESTROGENS, ANTITUMOR AGENTS | RESEARCH CORPORATION TECHNOLOGIES (US) | 1997-08-19 | — | — | US | disclosed |
| US-5658927-A | ANTIESTROGENS, ANTITUMOR AGENTS | RESEARCH CORPORATION TECHNOLOGIES (US) | 1997-08-19 | — | — | US | disclosed |
| US-4879315-A | Cyclopropyl analogs as anti-estrogenic, anti-tumor and female fertility agents | THE BOARD OF REGENTS FOR THE UNIVERSITY OF OKLAHOMA (US) | 1989-11-07 | — | — | US | disclosed |