Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | KIF11 | P52732 | 2/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | XDH | P47989 | 1/20 | 0.38 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.38 |
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | BRAF | P15056 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21597614 | 0.81 | NPC1 (0.41) | TDP1NOTUMMAPTRAB9ACYP11B2 | |
| SCHEMBL2545002 | 0.78 | TDP1 (0.45) | TDP1KIF11NOTUMMAPTRAB9A | |
| SCHEMBL14710285 | 0.77 | POLB (0.39) | TDP1RAB9A | |
| SCHEMBL544340 | 0.76 | MAPK1 (0.41) | NOTUMMAPTEGFR | |
| SCHEMBL8389202 | 0.70 | OPRD1 (0.54) | TDP1KIF11RAB9APTGS2 | |
| SCHEMBL11595644 | 0.70 | SCN5A (0.43) | TDP1KIF11NOTUMCYP11B2 | |
| SCHEMBL28452141 | 0.69 | MAPT (0.48) | TDP1KIF11NOTUMXDHMKNK1 | |
| SCHEMBL11060269 | 0.66 | TDP1 (0.47) | TDP1KIF11NOTUMXDHDHFR | |
| SCHEMBL18284894 | 0.66 | DHFR (0.42) | TDP1KIF11NOTUMXDHDHFR | |
| SCHEMBL11594125 | 0.66 | MAPK1 (0.40) | NOTUMMAPTCYP11B2PTGS2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5674886-A | AROMATASE INHIBITOR; BREAST CANCER; UROGENITAL DISORDERS | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1997-10-07 | — | — | US | disclosed |