Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP2A | P11388 | 12/20 | 0.40 |
| ▸ | CNR2 | P34972 | 3/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | NQO1 | P15559 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7818284 | 0.87 | NQO2 (0.38) | TOP2ACNR2BCHEACHENQO1 | |
| SCHEMBL7809943 | 0.87 | CNR2 (0.33) | TOP2ACNR2BCHEACHEMCHR1 | |
| SCHEMBL7821158 | 0.85 | TOP2A (0.35) | TOP2ACNR2BCHEACHENQO1 | |
| SCHEMBL7821575 | 0.83 | TOP2A (0.35) | TOP2ACNR2BCHESMN1; SMN2 | |
| SCHEMBL7819175 | 0.80 | NQO2 (0.39) | CNR2BCHEACHENQO1 | |
| SCHEMBL7804662 | 0.75 | TOP2A (0.48) | TOP2AKCNH2SMN1; SMN2KDM4ECYP3A4 | |
| SCHEMBL7817393 | 0.75 | KDM4E (0.35) | NQO1SMN1; SMN2KDM4ELMNACYP1A2 | |
| SCHEMBL7819985 | 0.73 | TOP2A (0.51) | TOP2A | |
| SCHEMBL7819169 | 0.72 | KDM4E (0.36) | TOP2AKDM4ELMNACYP1A2POLB | |
| SCHEMBL7812061 | 0.69 | TOP2A (0.45) | TOP2ANQO1KCNH2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0750619-B1 | HETERO-ANNULATED INDAZOLES | NOVUSPHARMA SPA (IT) | 2001-05-30 | — | — | EP | disclosed |
| US-5596097-A | ANTITUMOR AGENTS | THE UNIVERSITY OF VERMONT (US) | 1997-01-21 | — | — | US | disclosed |
| EP-0750619-A1 | HETERO-ANNULATED INDAZOLES | BOEHRINGER MANNHEIM ITALIA S.p.A. (IT) | 1997-01-02 | — | — | EP | disclosed |
| WO-1995024407-A1 | HETERO-ANNULATED INDAZOLES | BOEHRINGER MANNHEIM ITALIA, S.P.A. (IT) | 1995-09-14 | — | — | WO | disclosed |