Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | NQO2 | P16083 | 2/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7048394 | 1.00 | KMT2A (0.54) | KMT2AMEN1MAOBNQO2MTNR1A | |
| SCHEMBL7048396 | 1.00 | KMT2A (0.54) | KMT2AMEN1MAOBNQO2MTNR1A | |
| SCHEMBL3865950 | 0.89 | KMT2A (0.54) | KMT2AMEN1CYP19A1CYP11B2NPC1 | |
| SCHEMBL3865953 | 0.89 | KMT2A (0.54) | KMT2AMEN1CYP19A1CYP11B2NPC1 | |
| SCHEMBL6485760 | 0.89 | KMT2A (0.54) | KMT2AMEN1CYP19A1CYP11B2NPC1 | |
| SCHEMBL6476999 | 0.80 | KMT2A (0.68) | KMT2AMEN1ALDH1A1LMNAMAOA | |
| SCHEMBL6476988 | 0.80 | KMT2A (0.68) | KMT2AMEN1ALDH1A1LMNAMAOA | |
| SCHEMBL6476994 | 0.80 | KMT2A (0.68) | KMT2AMEN1ALDH1A1LMNAMAOA | |
| SCHEMBL246378 | 0.76 | PARP10 (0.63) | MTNR1AMTNR1BCYP19A1ALDH1A1ACHE | |
| SCHEMBL29438649 | 0.76 | PARP10 (0.63) | MTNR1AMTNR1BCYP19A1ALDH1A1ACHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2003014117-A1 | 3-SUBSTITUTED PYRROLO[2.1-A]ISOQUINOLINE DERIVATIVES | BAYER CORPORATION (US) | 2003-02-20 | — | — | WO | disclosed |
| WO-2003014115-A1 | 3-SUBSTITUTED PYRROLO (2.1-A) ISOQUINOLINE DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 2003-02-20 | — | — | WO | disclosed |