Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP2B | Q02880 | 11/20 | 0.54 |
| ▸ | TOP2A | P11388 | 10/20 | 0.54 |
| ▸ | KDM1A | O60341 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CASP1 | P29466 | 2/20 | 0.44 |
| ▸ | CASP7 | P55210 | 2/20 | 0.44 |
| ▸ | RAD52 | P43351 | 4/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | GLA | P06280 | 2/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.41 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.41 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | TOP1 | P11387 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9301299 | 0.87 | TOP2A (0.62) | TOP2BTOP2AKDM1ACYP1A2CYP2D6 | |
| SCHEMBL9300387 | 0.86 | TOP2A (0.72) | TOP2BTOP2AKDM1ACYP1A2CYP2D6 | |
| SCHEMBL9301457 | 0.86 | TOP2A (0.60) | TOP2BTOP2AKDM1ACYP1A2CYP2D6 | |
| SCHEMBL9300780 | 0.82 | TOP2A (0.61) | TOP2BTOP2AKDM1ACYP1A2CYP2D6 | |
| SCHEMBL9301553 | 0.80 | TOP2A (0.69) | TOP2BTOP2AKDM1ACYP1A2CYP2D6 | |
| SCHEMBL9299561 | 0.79 | TOP2A (0.60) | TOP2BTOP2AKDM1ACYP1A2CYP2D6 | |
| SCHEMBL9299922 | 0.79 | TOP2A (0.56) | TOP2BTOP2AKDM1ARAD52POLB | |
| SCHEMBL9300987 | 0.78 | TOP2A (0.63) | TOP2BTOP2AKDM1ACYP1A2CYP2D6 | |
| SCHEMBL9301141 | 0.78 | TOP2A (0.66) | TOP2BTOP2AKDM1ACYP1A2CYP2D6 | |
| SCHEMBL9301757 | 0.78 | TOP2A (0.57) | TOP2BTOP2AKDM1ACYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5354864-A | Antitumor agents | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1994-10-11 | — | — | US | claimed |
| WO-1993023049-A1 | 3-(9-ACRIDINYLAMINO)-5-HYDROXYMETHYLANILINE DERIVATIVES AS ANTICANCER AGENTS | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1993-11-25 | — | — | WO | claimed |
| US-5354864-A | Antitumor agents | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1994-10-11 | — | — | US | disclosed |