Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | GSTP1 | P09211 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.34 |
| ▸ | AGPAT2 | O15120 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | PRKX | P51817 | 1/20 | 0.33 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.33 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9349744 | 0.82 | KMT2A (0.39) | NPC1GSTP1MAOAMAOBALDH1A1 | |
| SCHEMBL28559769 | 0.78 | NPC1 (0.44) | ATMNPC1ALDH1A1CA12CA1 | |
| SCHEMBL9344603 | 0.76 | NPC1 (0.43) | NPC1GSTP1MAOAMAOBALDH1A1 | |
| SCHEMBL17022741 | 0.75 | NPC1 (0.47) | NPC1GSTP1ALDH1A1CA12CA1 | |
| SCHEMBL9344732 | 0.74 | ELANE (0.47) | NPC1ALDH1A1CA12CA1CA2 | |
| SCHEMBL9344775 | 0.74 | NPC1 (0.47) | NPC1GSTP1MAOAMAOBALDH1A1 | |
| SCHEMBL9345266 | 0.74 | NPC1 (0.47) | NPC1GSTP1ALDH1A1CA12CA1 | |
| SCHEMBL9345499 | 0.73 | LMNA (0.36) | ATMNPC1GSTP1MAOAMAOB | |
| SCHEMBL17264967 | 0.73 | NPC1 (0.46) | ATMNPC1MAOBNR4A2ALDH1A1 | |
| SCHEMBL28560297 | 0.72 | NPC1 (0.50) | NPC1ALDH1A1KDM4ECYP1A2CYP2D6 |
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-0457334-B1 | Carbonates of acetylenic alcohols | NIPPON PAINT CO LTD (JP) | 1994-08-10 | — | — | EP | disclosed |
| US-5258542-A | Carbonates of acetylenic alcohols | NIPPON PAINT CO., LTD. (JP) | 1993-11-02 | — | — | US | disclosed |
| US-5194653-A | Useful in making heat resistant liquid crystalline polymers | NIPPON PAINT COMPANY, LIMITED (JP) | 1993-03-16 | — | — | US | disclosed |
| EP-0457334-A1 | Carbonates of acetylenic alcohols | NIPPON PAINT CO., LTD. (JP) | 1991-11-21 | — | — | EP | disclosed |