Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 5/20 | 0.45 |
| ▸ | POLB | P06746 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | DDX3X | O00571 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL172153 | 0.86 | — | — | |
| SCHEMBL29370546 | 0.86 | — | — | |
| Phosphine SCHEMBL9401959 | 0.84 | MAPT (0.54) | TSHRHPGDPOLBMAPTALDH1A1 | |
| Hydrochloric Acid SCHEMBL2862264 | 0.84 | MAPT (0.54) | TSHRHPGDPOLBMAPTALDH1A1 | |
| Aniline SCHEMBL22169237 | 0.80 | MAPT (0.52) | TSHRHPGDPOLBMAPTALDH1A1 | |
| Phenol SCHEMBL6874450 | 0.78 | TDP1 (0.48) | HPGDPOLBMAPTALDH1A1TDP1 | |
| O-Xylene SCHEMBL10377391 | 0.78 | TSHR (0.69) | TSHRMAPTALDH1A1TDP1HTT | |
| Aniline SCHEMBL27577425 | 0.75 | TSHR (0.73) | TSHRMAPTALDH1A1TDP1HTT | |
| Alanine SCHEMBL27542248 | 0.75 | RAB9A (0.48) | HPGDPOLBALDH1A1TDP1KDM4E | |
| Hypophosphorous Acid SCHEMBL5935330 | 0.74 | NPC1 (0.52) | HPGDPOLBMAPTALDH1A1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106257976-A | Human plasma kallikrein inhibitors | 拜奥克里斯特制药公司 | 2016-12-28 | — | — | CN | disclosed |