Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.60 |
| ▸ | MAPT | P10636 | 4/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.60 |
| ▸ | PELI1 | Q96FA3 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | PTPRC | P08575 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9608493 | 0.85 | MAPT (0.52) | ALDH1A1MAPTNPSR1PELI1TSHR | |
| SCHEMBL11747623 | 0.83 | PELI1 (0.67) | ALDH1A1MAPTNPSR1PELI1TSHR | |
| SCHEMBL5685028 | 0.83 | ALDH1A1 (0.61) | ALDH1A1MAPTNPSR1PELI1TSHR | |
| Hydrochloric Acid SCHEMBL5685037 | 0.82 | ALDH1A1 (0.59) | ALDH1A1MAPTNPSR1PELI1TSHR | |
| Dinitrophenylene SCHEMBL27691692 | 0.81 | TSHR (0.74) | ALDH1A1TSHRALOX15LMNAHPGD | |
| SCHEMBL6572398 | 0.81 | PELI1 (0.60) | ALDH1A1MAPTNPSR1PELI1TSHR | |
| SCHEMBL16428783 | 0.81 | PELI1 (0.60) | ALDH1A1MAPTNPSR1PELI1TSHR | |
| SCHEMBL8051514 | 0.81 | ALDH1A1 (0.67) | ALDH1A1MAPTNPSR1TSHRPTPRC | |
| SCHEMBL1539358 | 0.80 | IKBKB (0.56) | ALDH1A1MAPTLMNAMEN1KMT2A | |
| SCHEMBL6852757 | 0.80 | TP53 (0.64) | PELI1SMN1; SMN2TDP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0852486-A2 | ANTIPLAQUE ORAL COMPOSITION | Colgate-Palmolive Company (US) | 1998-07-15 | — | — | EP | disclosed |
| US-5723500-A | WATER INSOLUBLE, NONCATIONIC, ANTIBACTERIAL, STERICALLY HINDERED PHENOL; MOUTHWASHES, DENTIFRICES | COLGATE-PALMOLIVE COMPANY (US) | 1998-03-03 | — | — | US | disclosed |
| WO-1997010800-A2 | ANTIPLAQUE ORAL COMPOSITION | COLGATE-PALMOLIVE COMPANY (US) | 1997-03-27 | — | — | WO | disclosed |
| US-4631119-A | Reversible, electrochemically-switched lariat ethers | W. R. GRACE & CO. (US) | 1986-12-23 | — | — | US | disclosed |