Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABAT | P80404 | 1/20 | 0.52 |
| ▸ | NOS1 | P29475 | 3/20 | 0.52 |
| ▸ | NOS2 | P35228 | 3/20 | 0.52 |
| ▸ | NOS3 | P29474 | 2/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
| ▸ | LOXL2 | Q9Y4K0 | 7/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.45 |
| ▸ | F10 | P00742 | 1/20 | 0.44 |
| ▸ | F11 | P03951 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.41 |
| ▸ | TPSAB1 | Q15661 | 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 | |
|---|---|---|---|---|
| SCHEMBL23892032 | 0.80 | NOS1 (0.48) | ABATNOS1NOS2NOS3HRH3 | |
| SCHEMBL6840057 | 0.80 | TAAR1 (0.56) | NOS1NOS2NOS3LOXL2KDM4E | |
| SCHEMBL11079658 | 0.80 | KDM4E (0.52) | ABATNOS1NOS2NOS3HRH3 | |
| Methyl Alcohol SCHEMBL22528993 | 0.80 | ABAT (0.67) | ABATNOS1NOS2NOS3HRH3 | |
| SCHEMBL15828 | 0.76 | HRH3 (0.79) | ABATNOS1NOS2NOS3HRH3 | |
| SCHEMBL6522029 | 0.76 | CA2 (0.54) | ABATKDM4ETAAR1 | |
| SCHEMBL4226247 | 0.76 | IDO1 (0.48) | SMN1; SMN2TAAR1 | |
| SCHEMBL6616424 | 0.76 | LPL (0.48) | SMN1; SMN2TAAR1 | |
| SCHEMBL1620786 | 0.74 | TDP1 (0.47) | LOXL2KDM4ESMN1; SMN2TAAR1 | |
| SCHEMBL10439461 | 0.74 | L3MBTL1 (0.47) | KDM4ESMN1; SMN2TAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6770650-B2 | CHEMOKINE RECEPTOR (CCR) ANTAGONISTS SUCH AS N-(1(S)-(4-(3,4-DICHLOROBENZYL)PIPERAZIN-1-YLMETHYL)-2-METHYLPROPYL)-4 -METHYLBENZAMIDE DIHYDROCHLORIDE SALT FOR TREATMENT OF ASTHMA | SYNTEX (U.S.A.) LLC | 2004-08-03 | — | — | US | disclosed |
| US-6323223-B1 | CCR-3 RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, METHODS FOR THEIR USE AND METHODS FOR PREPARING THESE COMPOUNDS. | SYNTEX (U.S.A.) LLC | 2001-11-27 | — | — | US | disclosed |
| CN-1268107-A | Linear acetal and ketal pro-fragrances | PROCTER & GAMBLE (US) | 2000-09-27 | — | — | CN | disclosed |
| CN-1268127-A | Pro-fragrance cyclic acetals | PROCTER & GAMBLE (US) | 2000-09-27 | — | — | CN | disclosed |
| CN-1233276-A | Rinse added fabric softening composition and method for delivery of pro-fragrances | PROCTER & GAMBLE (US) | 1999-10-27 | — | — | CN | disclosed |