Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.57 |
| ▸ | FBP1 | P09467 | 1/20 | 0.54 |
| ▸ | VCP | P55072 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9109568 | 0.87 | TSHR (0.57) | TSHRFBP1VCPLMNACYP1A2 | |
| SCHEMBL6158117 | 0.87 | TSHR (0.57) | TSHRFBP1VCPLMNACYP1A2 | |
| SCHEMBL27492647 | 0.87 | TSHR (0.57) | TSHRLMNACYP1A2CYP2D6CYP2C9 | |
| Hydrochloric Acid SCHEMBL11366225 | 0.85 | TSHR (0.56) | TSHRLMNACYP1A2CYP2D6CYP2C9 | |
| Hydrochloric Acid SCHEMBL11366214 | 0.85 | TSHR (0.56) | TSHRLMNACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9452244 | 0.83 | TSHR (0.57) | TSHRLMNACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL28743560 | 0.83 | TSHR (0.57) | TSHRLMNACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL28743562 | 0.83 | TSHR (0.57) | TSHRLMNACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL29624517 | 0.83 | TSHR (0.57) | TSHRLMNACYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9452246 | 0.83 | TSHR (0.57) | TSHRLMNACYP1A2CYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1013636-B1 | Preparation of allylic aromatic compounds | AMERSHAM HEALTH AS (NO) | 2003-07-09 | — | — | EP | disclosed |
| US-6284894-B1 | AROMATIC AMINE IS REACTED FIRST WITH A NITRITE AND THEN WITH AN ALLYLIC OLEFIN HAVING AN ELIMINATABLE TERMINAL SUBSTITUENT. | NYCOMED IMAGING AS (NO) | 2001-09-04 | — | — | US | disclosed |
| EP-1013636-A1 | Preparation of allylic aromatic compounds | NYCOMED IMAGING AS (NO) | 2000-06-28 | — | — | EP | disclosed |