Known targets — ChEMBL curated mechanism
ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A known ✓ | P35348 | 1/20 | 0.47 |
| ▸ | TUBB4A known ✓ | P04350 | 1/20 | 0.43 |
| ▸ | TUBB known ✓ | P07437 | 1/20 | 0.43 |
| ▸ | TUBA3C known ✓ | P0DPH7 | 1/20 | 0.43 |
| ▸ | TUBA1B known ✓ | P68363 | 1/20 | 0.43 |
| ▸ | TUBA4A known ✓ | P68366 | 1/20 | 0.43 |
| ▸ | TUBB4B known ✓ | P68371 | 1/20 | 0.43 |
| ▸ | TUBB3 known ✓ | Q13509 | 1/20 | 0.43 |
| ▸ | TUBB2A known ✓ | Q13885 | 1/20 | 0.43 |
| ▸ | TUBB8 known ✓ | Q3ZCM7 | 1/20 | 0.43 |
| ▸ | TUBA3E known ✓ | Q6PEY2 | 1/20 | 0.43 |
| ▸ | TUBA1A known ✓ | Q71U36 | 1/20 | 0.43 |
| ▸ | TUBA1C known ✓ | Q9BQE3 | 1/20 | 0.43 |
| ▸ | TUBB6 known ✓ | Q9BUF5 | 1/20 | 0.43 |
| ▸ | TUBB2B known ✓ | Q9BVA1 | 1/20 | 0.43 |
| ▸ | TUBB1 known ✓ | Q9H4B7 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.48 |
| ▸ | MEN1 | O00255 | 6/20 | 0.48 |
| ▸ | NPC1 | O15118 | 5/20 | 0.48 |
| ▸ | RAB9A | P51151 | 5/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL10687281 | 0.97 | KMT2A (0.49) | KMT2AMEN1NPC1RAB9AALDH1A1 | |
| SCHEMBL10689917 | 0.95 | NPC1 (0.50) | KMT2AMEN1NPC1RAB9AALDH1A1 | |
| SCHEMBL10687598 | 0.95 | KMT2A (0.53) | KMT2AMEN1NPC1RAB9AALDH1A1 | |
| Hydrochloric Acid SCHEMBL10692550 | 0.94 | KMT2A (0.52) | KMT2AMEN1NPC1RAB9AALDH1A1 | |
| Bromide SCHEMBL10687727 | 0.94 | KMT2A (0.52) | KMT2AMEN1NPC1RAB9AALDH1A1 | |
| SCHEMBL10686922 | 0.92 | KMT2A (0.48) | KMT2AMEN1NPC1RAB9AALDH1A1 | |
| Phosphoric Acid SCHEMBL10788725 | 0.91 | KMT2A (0.49) | KMT2AMEN1NPC1RAB9AALDH1A1 | |
| Nitric Acid SCHEMBL10690090 | 0.89 | KMT2A (0.48) | KMT2AMEN1NPC1RAB9AALDH1A1 | |
| SCHEMBL10688477 | 0.88 | KMT2A (0.49) | KMT2AMEN1NPC1RAB9AALDH1A1 | |
| SCHEMBL10684882 | 0.87 | NPC1 (0.62) | KMT2AMEN1NPC1RAB9AALDH1A1 |
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-4769384-A | ANTIULCER AGENTS | NIPPON SHINYAKU CO. LTD. (JP) | 1988-09-06 | — | — | US | disclosed |