Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CHUK | O15111 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29954996 | 0.86 | TSHR (0.42) | TSHRHPGDALDH1A1CHUKCYP1A2 | |
| SCHEMBL3231667 | 0.86 | TSHR (0.42) | TSHRHPGDALDH1A1CHUKCYP1A2 | |
| SCHEMBL28373050 | 0.85 | CYP1A2 (0.43) | TSHRHPGDALDH1A1CHUKCYP1A2 | |
| SCHEMBL13387995 | 0.84 | KDM4C (0.39) | ALDH1A1MAPTKDM4CKMT2AMEN1 | |
| SCHEMBL9000873 | 0.82 | DYRK1A (0.39) | TSHRHPGDALDH1A1CHUKCYP1A2 | |
| SCHEMBL2513360 | 0.82 | TSHR (0.46) | TSHRCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL10338664 | 0.80 | KDM4C (0.47) | TSHRHPGDALDH1A1CHUKDYRK1A | |
| SCHEMBL10780650 | 0.79 | SMN1; SMN2 (0.44) | TSHRHPGDALDH1A1MAPTKDM4C | |
| SCHEMBL1197794 | 0.79 | CYP17A1 (0.47) | RAB9A | |
| SCHEMBL29957527 | 0.79 | CYP17A1 (0.47) | RAB9A |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |