Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 2/20 | 0.39 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | RXRB | P28702 | 1/20 | 0.39 |
| ▸ | RXRG | P48443 | 1/20 | 0.39 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.39 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.38 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.38 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.38 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11670421 | 0.91 | NPC1 (0.46) | CYP19A1NPC1HPGDRAB9ASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL11875514 | 0.86 | EGFR (0.39) | CYP19A1NPC1HPGDRAB9ASMN1; SMN2 | |
| SCHEMBL11814480 | 0.82 | PDCD1 (0.48) | NPC1RAB9ASMN1; SMN2MEN1KMT2A | |
| SCHEMBL11826519 | 0.81 | BRD4 (0.39) | NPC1HPGDRAB9ASMN1; SMN2MEN1 | |
| SCHEMBL11670163 | 0.80 | ALOX5 (0.42) | NPC1HPGDRAB9ASMN1; SMN2EGFR | |
| Sulfuric Acid SCHEMBL11705657 | 0.80 | KMT2A (0.47) | RAB9ASMN1; SMN2MEN1KMT2AEGFR | |
| SCHEMBL11705297 | 0.79 | KMT2A (0.51) | RAB9ASMN1; SMN2MEN1KMT2AEGFR | |
| Hydrochloric Acid SCHEMBL11875519 | 0.79 | EGFR (0.44) | CYP19A1NPC1HPGDRAB9ASMN1; SMN2 | |
| SCHEMBL11875315 | 0.79 | KMT2A (0.40) | NPC1HPGDRAB9ASMN1; SMN2MEN1 | |
| Bromide SCHEMBL11705735 | 0.78 | KMT2A (0.50) | RAB9ASMN1; SMN2MEN1KMT2AEGFR |
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-4048229-A | ANTAGONIST ACTIVITY | SMITHKLINE CORPORATION (US) | 1977-09-13 | — | — | US | disclosed |