Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 6/20 | 0.49 |
| ▸ | RAB9A | P51151 | 6/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13078112 | 0.84 | NPC1 (0.47) | HTTNPC1RAB9AHSP90AA1TDP1 | |
| SCHEMBL13039993 | 0.84 | NPC1 (0.47) | HTTNPC1RAB9AHSP90AA1TDP1 | |
| SCHEMBL266172 | 0.84 | TDP1 (0.67) | HTTNPC1RAB9AHSP90AA1TDP1 | |
| SCHEMBL1530038 | 0.84 | HTT (0.76) | HTTNPC1RAB9AHSP90AA1KMT2A | |
| SCHEMBL4257916 | 0.83 | NPC1 (0.46) | HTTNPC1RAB9AHSP90AA1TDP1 | |
| SCHEMBL3297500 | 0.83 | NPC1 (0.46) | HTTNPC1RAB9AHSP90AA1TDP1 | |
| SCHEMBL12648508 | 0.79 | NPC1 (0.55) | HTTNPC1RAB9AHSP90AA1TDP1 | |
| SCHEMBL13066253 | 0.79 | NPC1 (0.44) | HTTNPC1RAB9AHSP90AA1TDP1 | |
| SCHEMBL27906466 | 0.79 | HTT (0.55) | HTTNPC1RAB9AHSP90AA1TDP1 | |
| SCHEMBL12648425 | 0.79 | KMT2A (0.54) | HTTNPC1RAB9AHSP90AA1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0596876-B1 | CHELATOR COMPOSITIONS COMPRISING ALPHA-DIAMINE COMPOUNDS | PROCTER & GAMBLE (US) | 2000-08-09 | — | — | EP | claimed |
| EP-0596876-A1 | CHELATOR COMPOSITIONS COMPRISING ALPHA-DIAMINE COMPOUNDS | THE PROCTER & GAMBLE COMPANY (US) | 1994-05-18 | — | — | EP | claimed |
| EP-0596876-A4 | CHELATOR COMPOSITIONS COMPRISING ALPHA-DIAMINE COMPOUNDS. | PROCTER & GAMBLE (US) | 1993-03-01 | — | — | EP | claimed |
| WO-1991016035-A1 | CHELATOR COMPOSITIONS COMPRISING ALPHA-DIAMINE COMPOUNDS | THE PROCTER & GAMBLE COMPANY (US) | 1991-10-31 | — | — | WO | claimed |
| US-5364617-A | Protection from solar radiation, chelate with iron in body and reduce its ability to catalyze formation of oxygen free radicals | THE PROCTER & GAMBLE COMPANY (US) | 1994-11-15 | — | — | US | disclosed |