Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | BLM | P54132 | 1/20 | 0.53 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.49 |
| ▸ | SCN1A | P35498 | 1/20 | 0.47 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.47 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL70372 | 0.91 | TSHR (0.57) | TSHRALDH1A1HIF1AMAPTCYP1A2 | |
| SCHEMBL905244 | 0.89 | ALDH1A1 (0.63) | TSHRALDH1A1HIF1AMAPTCYP1A2 | |
| Bicarbonate SCHEMBL27492793 | 0.87 | ALDH1A1 (0.62) | TSHRALDH1A1HIF1AMAPTCYP1A2 | |
| SCHEMBL19843863 | 0.84 | ALDH1A1 (0.54) | TSHRALDH1A1HIF1AMAPTCYP1A2 | |
| SCHEMBL69041 | 0.84 | TSHR (1.00) | TSHRALDH1A1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9031505 | 0.83 | LOXL2 (0.56) | TSHRALDH1A1HIF1AMAPTCYP1A2 | |
| SCHEMBL26988598 | 0.83 | SLC6A3 (0.55) | TSHRALDH1A1HIF1AMAPTCYP1A2 | |
| SCHEMBL8561232 | 0.82 | TSHR (0.55) | TSHRALDH1A1HIF1AMAPTCYP1A2 | |
| SCHEMBL28179236 | 0.82 | HIF1A (0.59) | TSHRALDH1A1HIF1AMAPTCYP1A2 | |
| SCHEMBL70322 | 0.82 | ALDH1A1 (0.66) | TSHRALDH1A1HIF1AMAPTCYP1A2 |
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-7304037-B2 | Cytostatic conjugates with integrin ligands | BAYER AKIENGESELLSCHAFT (DE) | 2007-12-04 | — | — | US | claimed |