Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PHGDH | O43175 | 5/20 | 0.77 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.69 |
| ▸ | MAPT | P10636 | 8/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.69 |
| ▸ | HPGD | P15428 | 6/20 | 0.69 |
| ▸ | MEN1 | O00255 | 6/20 | 0.69 |
| ▸ | LMNA | P02545 | 3/20 | 0.69 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.69 |
| ▸ | HTT | P42858 | 2/20 | 0.69 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.69 |
| ▸ | POLB | P06746 | 3/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.60 |
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL13886982 | 1.00 | PHGDH (0.77) | PHGDHALDH1A1MAPTKMT2AHPGD | |
| SCHEMBL4341230 | 0.88 | KMT2A (0.68) | PHGDHALDH1A1MAPTKMT2AHPGD | |
| SCHEMBL4341235 | 0.88 | KMT2A (0.68) | PHGDHALDH1A1MAPTKMT2AHPGD | |
| SCHEMBL20115468 | 0.87 | PHGDH (1.00) | PHGDHALDH1A1MAPTKMT2AHPGD | |
| SCHEMBL21292756 | 0.87 | PHGDH (1.00) | PHGDHALDH1A1MAPTKMT2AHPGD | |
| SCHEMBL24767664 | 0.87 | PHGDH (1.00) | PHGDHALDH1A1MAPTKMT2AHPGD | |
| SCHEMBL21292833 | 0.87 | PHGDH (0.85) | PHGDHALDH1A1MAPTKMT2AHPGD | |
| SCHEMBL29599198 | 0.87 | PHGDH (1.00) | PHGDHALDH1A1MAPTKMT2AHPGD | |
| SCHEMBL20115633 | 0.87 | PHGDH (0.85) | PHGDHALDH1A1MAPTKMT2AHPGD | |
| SCHEMBL21292670 | 0.87 | PHGDH (0.80) | PHGDHALDH1A1MAPTKMT2AHPGD |
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-7521062-B2 | Thiosemicarbazones as anti-virals and immunopotentiators | NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) | 2009-04-21 | — | — | US | disclosed |