Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14246523 | 0.76 | TSHR (0.50) | TSHRALDH1A1MEN1GAAKMT2A | |
| SCHEMBL14246552 | 0.70 | NPC1 (0.42) | TSHRALDH1A1GAANPC1ADAM17 | |
| SCHEMBL27877587 | 0.67 | CA2 (0.42) | TSHRALDH1A1MEN1GAAKMT2A | |
| SCHEMBL11889588 | 0.65 | NPC1 (0.44) | TSHRALDH1A1MEN1GAAKMT2A | |
| SCHEMBL3804426 | 0.65 | NPC1 (0.44) | TSHRALDH1A1MEN1GAAKMT2A | |
| SCHEMBL482384 | 0.64 | ESR1 (0.50) | TSHRALDH1A1MEN1GAAKMT2A | |
| SCHEMBL187341 | 0.63 | CYP2C19 (0.43) | ALDH1A1KMT2AMAPTMAPK1LMNA | |
| SCHEMBL1170985 | 0.63 | ALDH1A1 (0.42) | ALDH1A1KMT2AMAPTMAPK1LMNA | |
| Nitrobenzene SCHEMBL28265347 | 0.63 | ALDH1A1 (0.76) | TSHRALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL9202591 | 0.63 | ALDH1A1 (0.42) | ALDH1A1KMT2AMAPTMAPK1LMNA |
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-5700785-A | ADMINISTERING TO TREAT RETROVIRAL INFECTIONS | TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 1997-12-23 | — | — | US | disclosed |