Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 6/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 2/20 | 0.35 |
| ▸ | CDK9 | P50750 | 2/20 | 0.35 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 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 | |
|---|---|---|---|---|
| SCHEMBL14531775 | 0.81 | PARP1 (0.41) | PARP1MAPTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL435085 | 0.76 | PARP1 (0.41) | PARP1MAPTRAB9ANPC1CYP3A4 | |
| SCHEMBL8211001 | 0.75 | L3MBTL1 (0.39) | DRD2CYP1A2CYP2C19TBXA2RTP53 | |
| SCHEMBL18646102 | 0.73 | DRD2 (0.43) | DRD2PARP1TBXA2RMEN1KMT2A | |
| SCHEMBL14062929 | 0.71 | PARP1 (0.41) | PARP1 | |
| SCHEMBL29495957 | 0.71 | CDK2 (0.36) | PARP1CDK2CDK9ACHE | |
| SCHEMBL22969570 | 0.71 | CDK2 (0.36) | PARP1CDK2CDK9ACHE | |
| SCHEMBL14147026 | 0.71 | PARP1 (0.40) | PARP1MAPTRAB9ANPC1CYP3A4 | |
| SCHEMBL12467354 | 0.71 | PARP1 (0.51) | PARP1MAPTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL1836409 | 0.71 | PARP1 (0.35) | PARP1CDK2CDK9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006116165-A1 | CHROMANE AND CHROMENE DERIVATIVES AND USES THEREOF | WYETH (US) | 2006-11-02 | — | — | WO | disclosed |