Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
| ▸ | RXRB | P28702 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.37 |
| ▸ | LPL | P06858 | 1/20 | 0.37 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | SOD1 | P00441 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3681066 | 0.79 | SMN1; SMN2 (0.39) | SMN1; SMN2CYP2C19ALDH1A1LMNAMAPT | |
| SCHEMBL15232022 | 0.77 | NQO1 (0.33) | — | |
| SCHEMBL3680457 | 0.77 | ALDH1A1 (0.52) | SMN1; SMN2ALDH1A1LMNATP53LPL | |
| SCHEMBL3682108 | 0.73 | — | — | |
| SCHEMBL11725689 | 0.72 | TAAR1 (0.52) | SMN1; SMN2CYP2C19ALDH1A1LMNAMAPT | |
| SCHEMBL8925998 | 0.72 | SMN1; SMN2 (0.48) | SMN1; SMN2CYP2C19ALDH1A1LMNAMAPT | |
| SCHEMBL475215 | 0.72 | SMN1; SMN2 (0.48) | SMN1; SMN2CYP2C19ALDH1A1LMNAMAPT | |
| SCHEMBL15232680 | 0.71 | CYP3A4 (0.31) | — | |
| SCHEMBL36295 | 0.71 | TP53 (0.67) | SMN1; SMN2ALDH1A1LMNATP53TAAR1 | |
| SCHEMBL30878 | 0.70 | CA12 (0.61) | SMN1; SMN2ALDH1A1LMNAMAPTTP53 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100081770-A1 | GRAFTED AND FUNCTIONALIZED HIGH 1,4-TRANS POLYBUTADIENE WITH AROMATIC ORGANOSULFUR COMPOUND | KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) | 2010-04-01 | — | — | US | claimed |
| US-8552120-B2 | Grafted and functionalized high 1,4-trans polybutadiene with aromatic organosulfur compound | KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) | 2013-10-08 | — | — | US | disclosed |
| US-20100081770-A1 | GRAFTED AND FUNCTIONALIZED HIGH 1,4-TRANS POLYBUTADIENE WITH AROMATIC ORGANOSULFUR COMPOUND | KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) | 2010-04-01 | — | — | US | disclosed |