Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.39 |
| ▸ | SMYD2 | Q9NRG4 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8825516 | 1.00 | POLB (0.40) | POLBNPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL1117827 | 0.96 | MGLL (0.41) | — | |
| SCHEMBL10175323 | 0.96 | MGLL (0.41) | — | |
| SCHEMBL10175324 | 0.96 | MGLL (0.41) | — | |
| SCHEMBL28346561 | 0.93 | SMYD2 (0.40) | POLBNPSR1MEN1CYP3A4KMT2A | |
| SCHEMBL30563746 | 0.90 | SMYD2 (0.36) | POLBNPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL9886817 | 0.84 | MEN1 (0.47) | CYP1A2MEN1CYP3A4KMT2ATDP1 | |
| SCHEMBL20500291 | 0.84 | MEN1 (0.47) | CYP1A2MEN1CYP3A4KMT2ATDP1 | |
| SCHEMBL7203588 | 0.84 | MEN1 (0.47) | CYP1A2MEN1CYP3A4KMT2ATDP1 | |
| SCHEMBL18090633 | 0.84 | SMYD2 (0.39) | MEN1CYP3A4KMT2ATDP1ALDH1A1 |
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-5602245-A | REACTING PROTECTED DIHYDROFURAN WITH PROTECTED PURINE OR PYRIMIDINE BASE, ARYL SULFONYL COMPOUND, IN THE PRESENCE OF LEWIS CATALYST | EMORY UNIVERSITY (US) | 1997-02-11 | — | — | US | disclosed |