Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.58 |
| ▸ | MAPT | P10636 | 5/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | MAOA | P21397 | 4/20 | 0.41 |
| ▸ | MAOB | P27338 | 4/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13392612 | 0.91 | ALDH1A1 (0.46) | CYP3A4MAPTTDP1ALDH1A1L3MBTL1 | |
| SCHEMBL43388 | 0.86 | ALDH1A1 (0.42) | CYP3A4MAPTTDP1ALDH1A1L3MBTL1 | |
| SCHEMBL5516786 | 0.86 | ALDH1A1 (0.42) | CYP3A4MAPTTDP1ALDH1A1L3MBTL1 | |
| SCHEMBL823046 | 0.80 | ALDH1A1 (0.39) | CYP3A4MAPTTDP1ALDH1A1L3MBTL1 | |
| SCHEMBL28869065 | 0.78 | TSHR (0.42) | MAPTALDH1A1L3MBTL1CYP1A2KDM4E | |
| SCHEMBL172583 | 0.78 | CA12 (0.44) | MAPTALDH1A1CYP2C19TSHRHTT | |
| SCHEMBL6957549 | 0.78 | CYP3A4 (0.52) | CYP3A4MAPTTDP1ALDH1A1L3MBTL1 | |
| Benzene SCHEMBL28589541 | 0.77 | CYP3A4 (0.50) | CYP3A4MAPTTDP1ALDH1A1L3MBTL1 | |
| SCHEMBL10012838 | 0.77 | ALDH1A1 (0.43) | CYP3A4MAPTTDP1ALDH1A1CYP1A2 | |
| SCHEMBL10647182 | 0.75 | CALM1 (0.48) | CYP3A4TDP1ALDH1A1CYP2C9TSHR |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9067955-B2 | Copper-catalyzed formation of carbon-heteroatom and carbon—carbon bonds | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2015-06-30 | — | — | US | disclosed |
| US-5114975-A | Insecticides and miticides | CIBA-GEIGY CORPORATION (US) | 1992-05-19 | — | — | US | disclosed |
| EP-0304402-B1 | ANILINOPHENYL THIOUREAS, ISOTHIOUREAS AND CARBODIIMIDES, THEIR PREPARATION AND THEIR USE IN PEST-CONTROL | CIBA-GEIGY AG (CH) | 1992-05-06 | — | — | EP | disclosed |
| US-5026730-A | Anilinophenylthioureas, compositions containing them, and the use thereof in pest control | CIBA-GEIGY CORPORATION (US) | 1991-06-25 | — | — | US | disclosed |
| EP-0304402-A2 | Anilinophenyl thioureas, isothioureas and carbodiimides, their preparation and their use in pest-control | CIBA-GEIGY AG (CH) | 1989-02-22 | — | — | EP | disclosed |