Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 8/20 | 0.65 |
| ▸ | NPC1 | O15118 | 6/20 | 0.57 |
| ▸ | RAB9A | P51151 | 5/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | EGFR | P00533 | 1/20 | 0.50 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 2/20 | 0.49 |
| ▸ | DRD3 | P35462 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1388041 | 0.85 | DRD4 (0.69) | DRD4NPC1HTTHPGDDRD2 | |
| SCHEMBL1388460 | 0.82 | DRD4 (0.67) | DRD4NPC1RAB9AHTTHPGD | |
| SCHEMBL1388288 | 0.80 | DRD4 (0.65) | DRD4NPC1RAB9AHTTHPGD | |
| SCHEMBL1388193 | 0.80 | DRD4 (0.65) | DRD4NPC1HTTHPGDDRD2 | |
| SCHEMBL1388197 | 0.79 | DRD4 (1.00) | DRD4HTTHPGDDRD2DRD3 | |
| SCHEMBL15004236 | 0.77 | NPC1 (0.49) | NPC1RAB9ASMN1; SMN2TP53HTT | |
| SCHEMBL1388159 | 0.76 | DRD4 (0.66) | DRD4NPC1HTTHPGDDRD2 | |
| Hydrochloric Acid SCHEMBL8543107 | 0.76 | DRD4 (0.65) | DRD4NPC1HTTHPGDDRD2 | |
| SCHEMBL9091262 | 0.75 | BCHE (0.56) | DRD4RAB9ASMN1; SMN2TSHRHTT | |
| SCHEMBL2241896 | 0.75 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2TP53TSHR |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1235572-A2 | METHOD TO TREAT PAIN UTILIZING BENZIMIDAZOLE NMDA/NR2B ANTAGONISTS | MERCK SHARP & DOHME LTD. (GB) | 2002-09-04 | — | — | EP | claimed |
| US-6362196-B1 | N-METHYLASPARATIC ACID ANTAGONIST | MERCK & CO., INC. | 2002-03-26 | — | — | US | claimed |
| WO-2001030330-A2 | METHOD TO TREAT PAIN UTILIZING BENZIMIDAZOLE NMDA/NR2B ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 2001-05-03 | — | — | WO | claimed |
| EP-0689535-B1 | BENZIMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME (GB) | 1998-09-23 | — | — | EP | claimed |
| JP-H08508030-A | — | — | 1996-08-27 | — | — | JP | claimed |
| EP-0689535-A1 | BENZIMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME LTD. (GB) | 1996-01-03 | — | — | EP | claimed |
| WO-1994021615-A1 | BENZIMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME LIMITED (GB) | 1994-09-29 | — | — | WO | claimed |
| EP-1235572-A2 | METHOD TO TREAT PAIN UTILIZING BENZIMIDAZOLE NMDA/NR2B ANTAGONISTS | MERCK SHARP & DOHME LTD. (GB) | 2002-09-04 | — | — | EP | disclosed |
| US-6362196-B1 | N-METHYLASPARATIC ACID ANTAGONIST | MERCK & CO., INC. | 2002-03-26 | — | — | US | disclosed |
| WO-2001030330-A2 | METHOD TO TREAT PAIN UTILIZING BENZIMIDAZOLE NMDA/NR2B ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 2001-05-03 | — | — | WO | disclosed |
| EP-0689535-B1 | BENZIMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME (GB) | 1998-09-23 | — | — | EP | disclosed |
| US-5714498-A | Benzimidazole derivatives | MERCK, SHARP, & DOHME, LTD. (GB) | 1998-02-03 | — | — | US | disclosed |
| EP-0689535-A1 | BENZIMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME LTD. (GB) | 1996-01-03 | — | — | EP | disclosed |
| WO-1994021615-A1 | BENZIMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME LIMITED (GB) | 1994-09-29 | — | — | WO | disclosed |