Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.58 |
| ▸ | ACHE | P22303 | 3/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| Toluene SCHEMBL28200585 | 0.84 | TSHR (0.58) | TSHRACHELMNAALOX12ALDH1A1 | |
| Toluene SCHEMBL3036821 | 0.83 | TSHR (0.50) | TSHRACHELMNAALOX12ALDH1A1 | |
| Toluene SCHEMBL11841496 | 0.82 | TSHR (0.55) | TSHRACHELMNAALOX12ALDH1A1 | |
| O-Xylene SCHEMBL27880864 | 0.81 | TSHR (0.56) | TSHRACHEALDH1A1CYP2A6TP53 | |
| Biphenyl SCHEMBL27433633 | 0.81 | ALDH1A1 (0.50) | TSHRLMNAALDH1A1TP53HPGD | |
| Toluene SCHEMBL6372716 | 0.80 | TSHR (0.69) | TSHRACHELMNAALOX12ALDH1A1 | |
| Toluene SCHEMBL27260968 | 0.80 | ACHE (0.69) | TSHRACHELMNAALOX12ALDH1A1 | |
| Toluene SCHEMBL355333 | 0.80 | TSHR (0.69) | TSHRACHELMNAALOX12ALDH1A1 | |
| Toluene SCHEMBL17498723 | 0.80 | TSHR (0.69) | TSHRACHELMNAALOX12ALDH1A1 | |
| Toluene SCHEMBL28627614 | 0.80 | TSHR (0.52) | TSHRACHELMNAALOX12ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107848965-A | 4‑（Trifyl）The manufacture method of oxybenzene compound | 住友化学株式会社 | 2018-03-27 | — | — | CN | disclosed |
| CN-104402698-B | 2-(4-aminomethyl phenyl) propionic acid synthesize method | The rich safe Science and Technology Ltd. in Liuzhou (CN) | 2016-01-20 | — | — | CN | disclosed |
| US-5091274-A | Modified polysiloxanes | NATIONAL SCIENCE COUNCIL (TW) | 1992-02-25 | — | — | US | disclosed |