Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.49 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | F10 | P00742 | 1/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.45 |
| ▸ | NQO2 | P16083 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL27430704 | 0.88 | TSHR (0.55) | TSHRNPSR1P2RX1TMPRSS4CYP1A2 | |
| SCHEMBL14409902 | 0.84 | GAA (0.51) | TSHRNPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL2130017 | 0.83 | NPSR1 (0.50) | TSHRNPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL29977195 | 0.82 | ALDH1A1 (0.51) | TSHRNPSR1P2RX1TMPRSS4CYP1A2 | |
| SCHEMBL29785065 | 0.81 | TSHR (0.74) | TSHRNPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL29679686 | 0.81 | NPSR1 (0.55) | TSHRNPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL5788197 | 0.81 | NPSR1 (0.55) | TSHRNPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL2552734 | 0.81 | TSHR (0.74) | TSHRNPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL7256606 | 0.80 | KMT2A (0.50) | NPSR1MEN1KMT2AL3MBTL1F10 | |
| SCHEMBL2856689 | 0.80 | LMNA (0.55) | TSHRMEN1KMT2AL3MBTL1F10 |
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-0666260-B1 | 3-(2-aminoethyl)-4-3-(trifluoromethyl)benzoyl-3,4-dihydro-2H-1,4-benzoxazine derivatives, their preparation and use in therapy | SYNTHELABO (FR) | 1999-08-04 | — | — | EP | disclosed |
| US-5550125-A | BRAIN DISORDERS | SYNTHELABO (FR) | 1996-08-27 | — | — | US | disclosed |
| EP-0666260-A1 | 3-(2-aminoethyl)-4-3-(trifluoromethyl)benzoyl-3,4-dihydro-2H-1,4-benzoxazine derivatives, their preparation and use in therapy | SYNTHELABO (FR) | 1995-08-09 | — | — | EP | disclosed |