Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.75 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.59 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.54 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.54 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.54 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.54 |
| ▸ | CA12 | O43570 | 2/20 | 0.53 |
| ▸ | CA1 | P00915 | 2/20 | 0.53 |
| ▸ | CA2 | P00918 | 2/20 | 0.53 |
| ▸ | CA9 | Q16790 | 2/20 | 0.53 |
| ▸ | MMP1 | P03956 | 2/20 | 0.52 |
| ▸ | MMP2 | P08253 | 2/20 | 0.52 |
| ▸ | MMP9 | P14780 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL9634099 | 1.00 | MAOB (0.75) | MAOBCYP1A1CYP1B1CYP1A2HDAC3 | |
| SCHEMBL23895482 | 0.78 | MAOB (0.58) | MAOBCYP1A2HDAC3ADAM17HDAC1 | |
| SCHEMBL28908447 | 0.78 | MAOB (0.58) | MAOBCYP1A2HDAC3ADAM17HDAC1 | |
| SCHEMBL5809373 | 0.75 | EPHX2 (0.85) | MAOBCA12CA1CA2CA9 | |
| SCHEMBL6374235 | 0.75 | CYP1A1 (1.00) | MAOBCYP1A1CYP1B1CYP1A2HDAC3 | |
| SCHEMBL6200379 | 0.75 | CYP1A1 (1.00) | MAOBCYP1A1CYP1B1CYP1A2HDAC3 | |
| SCHEMBL6200382 | 0.75 | CYP1A1 (1.00) | MAOBCYP1A1CYP1B1CYP1A2HDAC3 | |
| SCHEMBL6374232 | 0.75 | CYP1A1 (1.00) | MAOBCYP1A1CYP1B1CYP1A2HDAC3 | |
| SCHEMBL2518624 | 0.75 | EPHX2 (0.76) | EPHX2TRPV1TGM2 | |
| SCHEMBL3462701 | 0.74 | MAOB (0.61) | MAOBCYP1A2HDAC3ADAM17HDAC1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5116850-A | Insecticides | E. I. DU PONT DE NEMOURS AND CO. (US) | 1992-05-26 | — | — | US | disclosed |
| US-5091405-A | Insecticidal pyrazolines | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1992-02-25 | — | — | US | disclosed |
| EP-0393120-A1 | HETEROCYCLIC PYRAZOLINE CARBOXANILIDES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1990-10-24 | — | — | EP | disclosed |
| EP-0330678-A1 | INSECTICIDAL PYRAZOLINES. | DU PONT (US) | 1989-09-06 | — | — | EP | disclosed |
| WO-1989005300-A1 | HETEROCYCLIC PYRAZOLINE CARBOXANILIDES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1989-06-15 | — | — | WO | disclosed |
| WO-1988006583-A1 | INSECTICIDAL PYRAZOLINES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1988-09-07 | — | — | WO | disclosed |