Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | NQO2 | P16083 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 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 | |
|---|---|---|---|---|
| SCHEMBL8946246 | 0.88 | CYP1A2 (0.42) | TDP1ALDH1A1NQO2LMNACYP1A2 | |
| SCHEMBL8946290 | 0.83 | NQO2 (0.53) | ALDH1A1NQO2KDM4EPOLB | |
| SCHEMBL8946957 | 0.82 | NQO2 (0.39) | KMT2AMEN1L3MBTL1TSHRALDH1A1 | |
| SCHEMBL8946276 | 0.78 | ACHE (0.40) | NQO2 | |
| SCHEMBL9380614 | 0.74 | HTR3A (0.40) | KMT2AMEN1TSHRNQO2LMNA | |
| SCHEMBL9462723 | 0.72 | NQO2 (0.52) | ALDH1A1NQO2KDM4ECYP1A2HPGD | |
| SCHEMBL1615754 | 0.71 | ALDH1A1 (0.46) | KMT2AMEN1ALDH1A1NQO2POLB | |
| SCHEMBL29617388 | 0.71 | ALDH1A1 (0.46) | KMT2AMEN1ALDH1A1NQO2POLB | |
| SCHEMBL1617936 | 0.70 | GABRA2 (0.42) | KMT2AMEN1L3MBTL1TDP1ALDH1A1 | |
| SCHEMBL17372709 | 0.70 | MAPT (0.45) | L3MBTL1ALDH1A1POLBMAPTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5493027-A | ANTIEPILEPTIC AGENTS, NEUROGENATIVE DISEASES | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 1996-02-20 | — | — | US | disclosed |