Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | CTSS | P25774 | 2/20 | 0.41 |
| ▸ | CTSK | P43235 | 2/20 | 0.41 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ITGAV | P06756 | 1/20 | 0.41 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | PRNP | P04156 | 1/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14265380 | 0.85 | ACE (0.53) | CYP1A2KMT2ACTSSCTSKCTSB | |
| SCHEMBL2300113 | 0.85 | ACE (0.53) | CYP1A2KMT2ACTSSCTSKCTSB | |
| SCHEMBL29858176 | 0.82 | GABRB1 (0.45) | CYP1A2KMT2ACTSSCTSKCTSB | |
| SCHEMBL19407482 | 0.82 | GABRB1 (0.45) | CYP1A2KMT2ACTSSCTSKCTSB | |
| SCHEMBL28824776 | 0.82 | GABRB1 (0.45) | CYP1A2KMT2ACTSSCTSKCTSB | |
| SCHEMBL9318798 | 0.80 | PTPN1 (0.49) | CYP1A2CTSSCTSKCTSBPTPN1 | |
| Leucine SCHEMBL7174148 | 0.77 | PTPN1 (0.44) | CTSSCTSKCTSBPTPN1ACE | |
| SCHEMBL7304085 | 0.76 | CTSL (0.48) | CYP1A2ADAMTS4KMT2ACTSSCTSK | |
| SCHEMBL7299398 | 0.76 | CTSL (0.48) | CYP1A2ADAMTS4KMT2ACTSSCTSK | |
| SCHEMBL2302074 | 0.75 | PTPN1 (0.42) | CYP1A2CTSSCTSKCTSBPTPN1 |
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-5346898-A | FOR TREATING FUNGAL INFECTIONS IN MAMMALS | SCHERING CORPORATION (US) | 1994-09-13 | — | — | US | disclosed |