Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FEN1 | P39748 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 3/20 | 0.40 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.40 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 3/20 | 0.40 |
| ▸ | SRC | P12931 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | TNKS | O95271 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL16625723 | 0.82 | MEN1 (0.53) | FEN1ALDH1A1HPGDTSHRHSD17B10 | |
| SCHEMBL12395945 | 0.79 | FEN1 (0.41) | FEN1EGFRDDB1CRBNPDE4A | |
| SCHEMBL280139 | 0.79 | GPR3 (0.58) | FEN1ALDH1A1HPGDEGFRSRC | |
| SCHEMBL8975764 | 0.78 | FEN1 (0.40) | FEN1ALDH1A1HPGDHSD17B10EGFR | |
| SCHEMBL16625727 | 0.78 | CCNB2 (0.42) | FEN1HPGDHSD17B10EGFRSRC | |
| SCHEMBL8976112 | 0.78 | BAZ2B (0.44) | ALDH1A1HPGDHSD17B10DDB1CRBN | |
| SCHEMBL18381782 | 0.78 | GPR3 (0.56) | FEN1ALDH1A1HPGDEGFRSRC | |
| SCHEMBL17339010 | 0.77 | FEN1 (0.46) | FEN1ALDH1A1TSHRDDB1CRBN | |
| SCHEMBL17034477 | 0.77 | DDB1 (0.51) | FEN1EGFRDDB1CRBNSRC | |
| SCHEMBL1609990 | 0.76 | FEN1 (0.56) | FEN1ALDH1A1HPGDEGFRSRC |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008016184-A1 | ALPHA-CARBOLINE DERIVATIVES AND METHODS FOR PREPARATION THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-02-07 | — | — | WO | disclosed |
| US-5532261-A | TREATING STAPHYLOCOCCUS INFECTIONS | MERCK & CO., INC. (US) | 1996-07-02 | — | — | US | disclosed |