Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.58 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11627384 | 0.89 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL9258004 | 0.85 | SMN1; SMN2 (0.61) | ALDH1A1SMN1; SMN2MEN1KMT2AHTT | |
| SCHEMBL29778821 | 0.85 | SMN1; SMN2 (0.61) | ALDH1A1SMN1; SMN2MEN1KMT2AHTT | |
| SCHEMBL9210392 | 0.85 | RAB9A (0.55) | ALDH1A1SMN1; SMN2MEN1KMT2AHTT | |
| SCHEMBL2508923 | 0.84 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2MEN1KMT2AHTT | |
| SCHEMBL28991799 | 0.84 | ALDH1A1 (0.64) | ALDH1A1SMN1; SMN2MEN1KMT2AHTT | |
| SCHEMBL1819010 | 0.83 | SMN1; SMN2 (0.56) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL6136662 | 0.82 | SMN1; SMN2 (0.60) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL20515053 | 0.82 | RAB9A (0.53) | ALDH1A1SMN1; SMN2MEN1KMT2AHTT | |
| SCHEMBL6136656 | 0.82 | SMN1; SMN2 (0.60) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102791697-A | Amino-pyrimidine compounds as inhibitors of TBKL and/or IKK epsilon | MYREXIS INC | 2012-11-21 | — | — | CN | disclosed |
| EP-0713483-B1 | AMIDINE DERIVATIVES WITH NITRIC OXIDE SYNTHETASE ACTIVITIES | ASTRAZENECA AB (SE) | 2003-01-15 | — | — | EP | disclosed |
| CN-1071746-C | Amidine derivatives with nitric oxide synthetase activities | ASTERA CO (SE) | 2001-09-26 | — | — | CN | disclosed |
| US-6030985-A | Amidine derivatives with nitric oxide synthetase activities | ASTRA AKTIEBOLAG (SE) | 2000-02-29 | — | — | US | disclosed |
| US-5807885-A | Amidine derivatives with nitric oxide synthetase activities | ASTRA AKTIEBOLAG (SE) | 1998-09-15 | — | — | US | disclosed |
| CN-1132505-A | Amidine derivatives with nitric oxide synthetase activities | ASTERA CO (SE) | 1996-10-02 | — | — | CN | disclosed |
| EP-0713483-A1 | AMIDINE DERIVATIVES WITH NITRIC OXIDE SYNTHETASE ACTIVITIES | Astra Aktiebolag (SE) | 1996-05-29 | — | — | EP | disclosed |
| WO-1995005363-A1 | AMIDINE DERIVATIVES WITH NITRIC OXIDE SYNTHETASE ACTIVITIES | ASTRA AKTIEBOLAG (SE) | 1995-02-23 | — | — | WO | disclosed |