Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 3/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | CA9 | Q16790 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | MITF | O75030 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL24510719 | 0.94 | TSHR (0.50) | TSHRNPC1LMNAMAPK1ALOX15 | |
| SCHEMBL24511018 | 0.91 | TSHR (0.47) | TSHRNPC1LMNAMAPK1ALOX15 | |
| SCHEMBL9034674 | 0.87 | ALDH1A1 (0.61) | TSHRNPC1LMNAMAPK1ALOX15 | |
| SCHEMBL24511010 | 0.86 | TSHR (0.44) | TSHRNPC1LMNAMAPK1ALOX15 | |
| SCHEMBL18237266 | 0.86 | NPC1 (0.55) | TSHRNPC1LMNAMAPK1ALOX15 | |
| SCHEMBL13186244 | 0.83 | ALDH1A1 (0.61) | TSHRNPC1LMNAMAPK1ALOX15 | |
| SCHEMBL15224105 | 0.78 | TDP1 (0.57) | TSHRNPC1POLBALDH1A1CYP2D6 | |
| SCHEMBL24511015 | 0.77 | LMNA (0.48) | TSHRNPC1LMNAMAPK1ALOX15 | |
| SCHEMBL23523479 | 0.76 | CYP2D6 (0.49) | TSHRPOLBPKMCYP2D6EPHX1 | |
| SCHEMBL15224298 | 0.75 | EPHX1 (0.52) | TSHRNPC1CYP2D6EPHX1CA12 |
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-2022123462-A1 | RADIOLABELLED PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA) INHIBITORS AND USE THEREOF | 3B PHARMACEUTICALS GMBH (DE) | 2022-06-16 | — | — | WO | disclosed |