Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ACP1 | P24666 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MC4R | P32245 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | JAK3 | P52333 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7183846 | 0.78 | GBA1 (0.47) | KMT2ASMN1; SMN2 | |
| Bromide SCHEMBL7608555 | 0.75 | GBA1 (0.44) | KMT2ASMN1; SMN2 | |
| SCHEMBL17553578 | 0.75 | CHRNB2 (0.49) | KMT2AALDH1A1MAPTSMN1; SMN2KDM4E | |
| SCHEMBL12133623 | 0.73 | KMT2A (0.76) | KMT2AHDAC1HDAC6ALDH1A1MAPT | |
| SCHEMBL10188221 | 0.72 | HTR2C (0.51) | KMT2AHDAC1HDAC6ALDH1A1MAPT | |
| Bromide SCHEMBL9096258 | 0.71 | EED (0.41) | KMT2AACP1 | |
| SCHEMBL9015445 | 0.71 | GBA1 (0.41) | KMT2AALDH1A1MAPT | |
| SCHEMBL30589132 | 0.71 | GBA1 (0.61) | KMT2APOLB | |
| SCHEMBL15918525 | 0.70 | ALDH1A1 (0.51) | KMT2AHDAC1HDAC6ALDH1A1SMN1; SMN2 | |
| SCHEMBL20808158 | 0.70 | L3MBTL1 (0.46) | HDAC1ALDH1A1MAPTSMN1; SMN2HTR2C |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0329737-B1 | TRI-AZA MACROCYCLES AND METAL COMPLEXES THEREOF | CELLTECH THERAPEUTICS LTD (GB) | 1995-04-12 | — | — | EP | disclosed |
| US-5247075-A | Imaging agents, cytotoxic agents | CELLTECH LIMITED (GB) | 1993-09-21 | — | — | US | disclosed |
| EP-0329737-A1 | TRI-AZA MACROCYCLES AND METAL COMPLEXES THEREOF | CELLTECH THERAPEUTICS LIMITED (GB) | 1989-08-30 | — | — | EP | disclosed |
| WO-1989001475-A1 | TRI-AZA MACROCYCLES AND METAL COMPLEXES THEREOF | CELLTECH LIMITED (GB) | 1989-02-23 | — | — | WO | disclosed |