Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.46 |
| ▸ | GABRP | O00591 | 2/20 | 0.44 |
| ▸ | GABRD | O14764 | 2/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.44 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.44 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.44 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.44 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.44 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.44 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.44 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.44 |
| ▸ | GABRE | P78334 | 2/20 | 0.44 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.44 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.44 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.44 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | RNASEH1 | O60930 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11248839 | 0.87 | ADORA3 (0.48) | PBRM1ADORA3GABRPGABRDGABRA1 | |
| SCHEMBL11541951 | 0.78 | HAVCR2 (0.52) | ADORA3GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL11545191 | 0.75 | HAVCR2 (0.43) | ADORA3GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL11543348 | 0.73 | ADORA3 (0.61) | ADORA3GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL11547087 | 0.72 | ADORA3 (0.60) | ADORA3GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL11258739 | 0.71 | ADORA3 (0.74) | ADORA3GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL11623219 | 0.71 | ADORA3 (0.53) | ADORA3GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL11636599 | 0.70 | KDM4E (0.45) | KDM4EALDH1A1KMT2AMEN1GAA | |
| SCHEMBL4224716 | 0.69 | HPGD (0.67) | KDM4EALDH1A1HPGDPARP1KMT2A | |
| SCHEMBL11084193 | 0.69 | GABRP (0.64) | ADORA3GABRPGABRDGABRA1GABRB1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4179561-A | REACTING A 3-DIAZOOXINDOLE WITH A SUBSTITUTED ACETYLENE | E. R. SQUIBB & SONS, INC. (US) | 1979-12-18 | — | — | US | disclosed |
| US-4112096-A | ANTIALLERGENS | E. R. SQUIBB & SONS, INC. (US) | 1978-09-05 | — | — | US | disclosed |
| US-4076818-A | ANTIALLERGENS | E. R. SQUIBB & SONS, INC. (US) | 1978-02-28 | — | — | US | disclosed |