Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.63 |
| ▸ | TSHR | P16473 | 1/20 | 0.62 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.55 |
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | IDO1 | P14902 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.49 |
| ▸ | LTA4H | P09960 | 1/20 | 0.48 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 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 | |
|---|---|---|---|---|
| Paranitrobenzyl Alcohol SCHEMBL114620 | 0.94 | TSHR (0.69) | POLBTSHRLOXL2CA1CA2 | |
| SCHEMBL44366 | 0.89 | POLB (0.76) | POLBTSHRLOXL2CA12CA1 | |
| SCHEMBL8087428 | 0.89 | POLB (0.76) | POLBTSHRLOXL2CA12CA1 | |
| SCHEMBL8094050 | 0.89 | POLB (0.76) | POLBTSHRLOXL2CA12CA1 | |
| Paranitrobenzyl Alcohol SCHEMBL28621041 | 0.86 | ALDH1A1 (0.64) | POLBTSHRLOXL2CYP2C19ALDH1A1 | |
| Paranitrobenzyl Alcohol SCHEMBL28005884 | 0.86 | AKR1C3 (0.61) | POLBTSHRLOXL2CA12CA1 | |
| SCHEMBL3887887 | 0.84 | TSHR (0.89) | POLBTSHRLOXL2CA12CA1 | |
| SCHEMBL7938059 | 0.83 | POLB (0.63) | POLBTSHRLOXL2CA12CA1 | |
| SCHEMBL8094543 | 0.83 | POLB (0.68) | POLBTSHRLOXL2CA12CA1 | |
| SCHEMBL4598350 | 0.82 | HSPB1 (0.59) | POLBTSHRLOXL2CA1CA2 |
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-2015151068-A1 | SYNTHETIC ANALOGUES OF 3-IODOTHYRONAMINE (T1AM) AND USES THEREOF | UNIVERSITA' DI PISA (IT) | 2015-10-08 | — | — | WO | disclosed |