Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ACHE | P22303 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | SCN1A | P35498 | 1/20 | 0.39 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.39 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21754357 | 0.77 | CYP2C19 (0.49) | CYP2D6KDM4EACHETSHRCYP3A4 | |
| SCHEMBL7485649 | 0.77 | CYP2C19 (0.49) | CYP2D6KDM4EACHETSHRCYP3A4 | |
| SCHEMBL7485644 | 0.77 | CYP2C19 (0.49) | CYP2D6KDM4EACHETSHRCYP3A4 | |
| SCHEMBL20963316 | 0.76 | CYP2D6 (0.47) | CYP2D6KDM4EACHETSHRCYP3A4 | |
| SCHEMBL6336267 | 0.73 | KDM4E (0.58) | CYP2D6KDM4EACHETSHRCYP3A4 | |
| SCHEMBL30390377 | 0.73 | KDM4E (0.58) | CYP2D6KDM4EACHETSHRCYP3A4 | |
| SCHEMBL3904370 | 0.73 | PKM (0.54) | CYP2D6KDM4EACHETSHRCYP3A4 | |
| SCHEMBL25227731 | 0.72 | KDM4E (0.47) | CYP2D6KDM4EACHETSHRCYP3A4 | |
| SCHEMBL30403664 | 0.72 | KDM4E (0.47) | CYP2D6KDM4EACHETSHRCYP3A4 | |
| SCHEMBL12341987 | 0.72 | KDM4E (0.50) | CYP2D6KDM4EACHETSHRCYP3A4 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6127189-A | CONTACTING WITH A 1,2-INDANEDIONE DERIVATIVE, MEASURING ABSORBANCE OR FLUORESCENCE OF PRODUCT FORMED, AND COMPARING TO STANDARDS | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2000-10-03 | — | — | US | claimed |
| WO-1998020344-A1 | COMPOSITIONS AND METHODS FOR DETECTION OF AN AMINE COMPOUND | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1998-05-14 | — | — | WO | claimed |
| EP-3480187-B1 | METHOD FOR PREPARING INDENOISOQUINOLINE DERIVATIVES | UNIV NAT TAIWAN NORMAL (TW) | 2023-10-04 | — | — | EP | disclosed |
| US-7374580-B2 | Dyeing compositions comprising A 1,2-indandione derivative | L'OREAL S.A. (FR) | 2008-05-20 | — | — | US | disclosed |
| US-7374580-B2 | Dyeing compositions comprising A 1,2-indandione derivative | L'OREAL S.A. (FR) | 2008-05-20 | — | — | US | disclosed |
| US-6127189-A | CONTACTING WITH A 1,2-INDANEDIONE DERIVATIVE, MEASURING ABSORBANCE OR FLUORESCENCE OF PRODUCT FORMED, AND COMPARING TO STANDARDS | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2000-10-03 | — | — | US | disclosed |
| WO-1998020344-A1 | COMPOSITIONS AND METHODS FOR DETECTION OF AN AMINE COMPOUND | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1998-05-14 | — | — | WO | disclosed |