Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR2 | P21452 | 4/20 | 0.37 |
| ▸ | NT5E | P21589 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA4 | P22748 | 2/20 | 0.35 |
| ▸ | CA5A | P35218 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 5/20 | 0.35 |
| ▸ | PTPN2 | P17706 | 3/20 | 0.35 |
| ▸ | PTPN11 | Q06124 | 3/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | CDC25B | P30305 | 4/20 | 0.34 |
| ▸ | PTPN6 | P29350 | 2/20 | 0.34 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.34 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.34 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5688905 | 0.83 | TACR2 (0.38) | TACR2NT5ECA12CA1CA2 | |
| SCHEMBL3490324 | 0.83 | CA12 (0.50) | TACR2CA12CA1CA2CA4 | |
| SCHEMBL3490348 | 0.82 | TACR2 (0.39) | TACR2NT5ECA12CA1CA2 | |
| SCHEMBL18942038 | 0.82 | CA12 (0.51) | TACR2CA12CA1CA2CA4 | |
| SCHEMBL3489164 | 0.81 | TACR2 (0.38) | TACR2NT5ECA12CA1CA2 | |
| SCHEMBL13498635 | 0.81 | TACR2 (0.41) | TACR2NT5ECA12CA1CA2 | |
| SCHEMBL20820953 | 0.81 | KMT2A (0.46) | TACR2NT5ECA12CA1CA2 | |
| SCHEMBL14429227 | 0.78 | HTR1A (0.47) | TACR2NT5ECA1CA2PTPN1 | |
| SCHEMBL1029965 | 0.78 | HTR1A (0.47) | TACR2NT5ECA1CA2PTPN1 | |
| SCHEMBL16237994 | 0.78 | HTR1A (0.47) | TACR2NT5ECA1CA2PTPN1 |
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-5998595-A | Azidohalogenobenzyl derivatives, sugar compounds and protection of hydroxy groups | WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) | 1999-12-07 | — | — | US | disclosed |